Compounds > chloral hydrate
Page last updated: 2024-09-20

chloral hydrate

Cross-References

ID SourceID
PubMed CID2707
CHEMBL ID455917
CHEBI ID28142
SCHEMBL ID34327
MeSH IDM0004114

Synonyms (138)

Synonym
LS-12935
sk-chloral hydrate
sontec
somni sed
escre
nycton
rectules
nycoton
chloraldurat
2,2-trichloro-1,1-ethanediol
lycoral
kessodrate
chloral monohydrate
noctec
chloradorm
oradrate
somnos
bi 3411
felsules
phaldrone
trichloroacetaldehyde monohydrate
nsc-3210
hynos
hydral
lorinal
1,1-trichloro-2,2-dihydroxyethane
tosyl
nsc3210
trichloroacetaldehyde hydrate
dormal
1, 2,2,2-trichloro-
cohidrate
wln: qyqxggg
trawotox
trichloracetaldehyd-hydrat
chloralhydrat
CHEBI:28142 ,
somnote
aquachloral supprettes
2,2,2-trichloro-1,1-ethanediol
knockout drops
1,1,1-trichloro-2,2-dihydroxyethane
1,1,1-trichloro-2,2-ethanediol
chloralhydrate
epa pesticide chemical code 268100
trichloracetaldehyd-hydrat [german]
chloraldurat [german]
brn 1698497
nsc 3210
caswell no. 168
chloralvan
ccris 4142
nortec
chloraldural [swiss]
hydrate de chloral
aquachloral
einecs 206-117-5
chloralex
hsdb 222
trichloroacetaldehyde, hydrated
dea no. 2465
chlorali hydras
ai3-00082
ethanediol, 2,2,2-trichloro-
novochlorhydrate
kloralhydrat
2,2,2-trichloroethane-1,1-diol ,
inchi=1/c2h3cl3o2/c3-2(4,5)1(6)7/h1,6-7
1,1-ethanediol, 2,2,2-trichloro-
C06899
chloral hydrate ,
302-17-0
DB01563
NCGC00159374-02
D00265
chloral hydrate (jp17/usp)
noctec (tn)
hydrate, chloral
chloral hydrate, meets analytical specification of ph. eur., bp, usp, 99.5-101%
chloral hydrate, crystallized, >=98.0% (t)
cloral hydrate
chloralum
CHEMBL455917
NCGC00159374-04
NCGC00159374-03
AKOS009157238
NCGC00257664-01
dtxsid7020261 ,
tox21_200110
cas-302-17-0
dtxcid70261
tox21_111614
418m5916wg ,
unii-418m5916wg
chloraldural
chloral hydrate [usp:ban:jan]
4-01-00-03143 (beilstein handbook reference)
chloral hydrate [vandf]
chloral hydrate [who-dd]
chloral hydrate [jan]
chloral hydrate [green book]
chloral hydrate [ep monograph]
chloral hydrate [mi]
chloral hydrate [who-ip]
cloral hydrate [mart.]
chloral hydrate [ep impurity]
chloral hydrate [usp monograph]
chloral hydrate [hsdb]
chloral hydrate [iarc]
chlorali hydras [who-ip latin]
chloralum [hpus]
SCHEMBL34327
tox21_111614_1
Q-200826
STL445706
J-520014
F0001-0929
chloral hydrate, saj special grade, >=99.7%
chloral hydrate, saj first grade, >=99.5%
chloral hydrate, p.a., 99.0%
chloralhydrate 1000 microg/ml in acetonitrile
Q412340
chloral hydrate 1000 microg/ml in methanol
2,2,2-trichloroethane-1,1-diol;trichloroacetaldehyde hydrate
BCP31225
chloral hydrate;2,2,2-trichloro-1,1-ethanediol;1,1-ethanediol, 2,2,2-trichloro-;choral hydrate;2,2,2-trichloroethane-1,1-diol;2,2,2trichloroethane1,1diol
trichloroethanal hydrate
A936505
trichloro acetaldehyde hydrate chloral hydrate
chloral hydrate (ep impurity)
chloral hydrate (ep monograph)
cloral hydrate (mart.)
chloral, monohydrate
chloral hydrate (usp monograph)
chloral hydrate (usp:ban:jan)
chloral hydrate (iarc)
chloraldural (swiss)
trichloroethylidene glycol

Research Excerpts

Overview

ExcerptReference
"Chloral hydrate is a commonly used sedative for children."( Gu, L; Li, S; Lu, Y; Peng, C; Wu, Y; Xie, L, 2023)
"Chloral hydrate is a sedative-hypnotic drug widely used for relieving fear and anxiety in pediatric patients. "( Jang, IS; Kim, G; Kim, H, 2023)
"Chloral hydrate (CH) is a sedative that has been widely used, but its rectal use for child sedation after head trauma has rarely been studied."( Ding, H; Hui, P; Nie, Q; Wang, Z, 2021)
"Chloral hydrate (CH) is a common disinfection by-product found in treated water, and its effective control is important to human health. "( Chen, B; Gan, Y; Guo, X; Jassby, D; Ma, S, 2019)
"Chloral hydrate is a sedative that has been used for many years in clinical practice and, under proper conditions, gives a deep and long enough sleep to allow performance of objective hearing tests in young children. "( Blebea, C; Cozma, S; Necula, V; Stamate, MC, 2019)
"Chloral hydrate is a sedative that has been used for magnetic resonance imaging (MRI)."( Angel, GJ; Arango, A; Calvo, V; Delgado, J; Delgado, JA; Rascovsky, S; Toro, R, 2015)
"Chloral hydrate is an appropriate sedation option for pediatric patients in MRI services when strict patient selection criteria are met. "( Angel, GJ; Arango, A; Calvo, V; Delgado, J; Delgado, JA; Rascovsky, S; Toro, R, 2015)
"Chloral hydrate is a clinical sedative."( Ma, Y; Sun, Y; Wang, J; Zhou, M; Zong, W, 2015)
"Chloral hydrate (CH) is a disinfection byproduct commonly found in disinfected water, and once formed, CH may undergo several transformation processes in water distribution system. "( Chen, B; Guo, X; Ma, S, 2016)
"Chloral hydrate is a clinical anesthetic drug and sedative that has also been reported to attenuate inflammatory response, but the mechanisms are not clearly understood."( Cai, J; Chen, Q; Chen, T; He, Y; Liao, H; Pan, Q; Peng, Y; Wu, P; Xie, T; Zhang, L, 2016)
"Chloral hydrate (CH) is an oral sedative widely used to sedate infants and young children during auditory brainstem response (ABR) testing. "( Avlonitou, E; Balatsouras, DG; Douniadakis, D; Giannakopoulos, P; Margaritis, E; Tsakanikos, M, 2011)
"Chloral hydrate is a sedative commonly used in pediatric medicine. "( Dogan, H; Ikbal, M; Ors, R; Pirim, I; Tastekin, A, 2004)
"Chloral hydrate is a safe and effective agent for sedation in children with an age and weight dependent response."( Al-Eissa, YA; Haidar, NA; Hijazi, OM, 2005)
"Chloral hydrate is a widely used hypnotic drug for children and animals but the possible interactions of its sedative action and thyroid hormones has not been investigated. "( Bolaris, S; Constantinou, C; Margarity, M; Valcana, T, 2005)
"Chloral hydrate (CH) is a short-lived intermediate in the metabolism of trichloroethylene (TRI). "( Bull, RJ; Hu, M; Merdink, JL; Parker, JC; Robison, LM; Stevens, DK, 2008)
"Chloral hydrate is a potent non-ionic dissociating agent for cytochrome c oxidase and its use in polyacrylamide-gel electrophoresis, with variation in the pH of the gel, permits charge-dependent separations that should have general application in the analysis of membrane proteins."( Griffin, DC; Landon, M, 1981)
"Chloral hydrate is an oral sedative commonly used in pediatric dentistry when providing extensive treatment in the young child. "( De Ball, S; Duncan, WK; Perkins, TM, 1994)
"Chloral hydrate is a sedative/hypnotic agent that is sometimes administered to patients being treated with cyclophosphamide."( Maki, PA; Sladek, NE, 1993)
"Chloral hydrate is a safe and effective agent for sedation of children with known or suspected congenital heart disease who are undergoing echocardiography in the outpatient cardiology clinic."( Ingall, CG; Martin, GR; Napoli, KL, 1996)
"Chloral hydrate is a hepatocarcinogen in mice but not rats. "( Beland, FA; Fullerton, NF; Schmitt, TC; Young, JF, 1998)
"Chloral hydrate is an old psychotropic agent that has never been adequately assessed in the clinical setting. "( , 1998)
"Chloral hydrate (CH) is a commonly found disinfection by-product in water purification, a metabolite of trichloroethylene, and a sedative/hypnotic drug. "( Bull, RJ; Merdink, JL; Parker, JC; Stenner, RD; Stevens, DK, 1999)
"Chloral hydrate (CH) is a widely used oral sedative hypnotic drug. "( Nichols, M; Palmisano, P; Pershad, J, 1999)
"Chloral hydrate (CH) is a widely used sedative. "( Henderson, GN; James, MO; Stacpoole, PW; Yan, Z, 1999)
"Chloral hydrate is a dangerous hypnotic drug to prescribe. "( de Groot, G; Gerretsen, M; Maes, RA; van Heijst, AN, 1979)
"Chloral hydrate is a compound of environmental significance. "( Abrahams, C; Ghose, T; Rao, KV; Rijhsinghani, KS; Swerdlow, MA, 1986)

Effects

ExcerptReference
"Chloral hydrate has been used medicinally since the 1800 s as a sedative hypnotic, most commonly for procedural sedation. "( Clark, RF; Hardmaslani, M; Nordt, SP; Rangan, C; Valente, M; Wendler, C, 2014)
"Chloral hydrate has limited availability in some countries, creating the need for alternative effective sedatives."( Hossain, M; Kurth, D; Loepke, A; Miller, J; Xue, B; Zhang, MZ, 2016)
"Chloral hydrate has been the drug of choice for uncooperative infants and children requiring sedation for echocardiography. "( Frommelt, PC; Hill, GD; Walbergh, DB, 2016)
"Chloral hydrate has been one of the sedative drugs most used in children over the last 3 decades, with supporting evidence for its efficacy and safety."( Barbi, E; Cozzi, G; Norbedo, S, 2017)
"Chloral hydrate medication has to be considered as a cause for false-positive EtG screening results by the DRI EtG immunoassay even in cases with regular chloral hydrate treatment (250-1000 mg) and the more in patients with chloral hydrate tolerance (taking g/day)."( Arndt, T; Gierten, B; Grüner, J; Güssregen, B; Werle, A, 2009)
"Chloral hydrate has been long used as a safe sedative and hypnotic drug in humans. "( Han, P; Kang, YJ; Song, H; Xie, H; Yang, P, 2011)
"Chloral hydrate has been found in our drinking water supplies at levels up to 5 micrograms/1. "( Borzelleca, JF; Douglas, KA; Kauffmann, BM; Munson, AE; Sain, LE; Sanders, VM; White, KL, 1982)
"Chloral hydrate has been found in our drinking water supplies at levels up to 5 micrograms/1. "( Barnes, DW; Borzelleca, JF; Bradshaw, TJ; Douglas, KA; Kauffmann, BM; Munson, AE; Sain, LE; Sanders, VM; White, KL, 1982)
"Chloral hydrate has been shown to be genotoxic in numerous prokaryotic and eukaryotic assay systems including human lymphocytes in vitro."( Beland, FA, 1999)
"Chloral hydrate has been time honored for pediatric procedural sedation, but its efficacy in sedation for emergency department (ED) procedures is unreported. "( Binder, LS; Leake, LA, 1991)
"Chloral hydrate (CH) has been assayed for its ability to induce chromosome number variation in human lymphocytes in culture. "( De Carli, L; De Sario, A; Vagnarelli, P, 1990)
"Chloral hydrate has been used extensively to sedate children, but at Brooke Army Medical Center, other drug combinations were becoming increasingly popular due to a perception that chloral hydrate had a high rate of failure, especially with younger or neurologically impaired children. "( Atkinson, SW; Fox, DJ; Rumm, PD; Takao, RT, 1990)
"Chloral hydrate has been used clinically for over 100 years. "( Gorecki, DK; Hindmarsh, KW; Kasian, GF; Reimche, LD; Sankaran, K; Tan, L, 1989)

Actions

ExcerptReference
"Chloral hydrate as cause for suspected ADR was classified as probable in 39 events (35.5%) and as possible in 70 (63.6%), and no event was classified as definite."( Carvalho, PR; Martinbiancho, JK; Moreira, LB; Rau, R; Schweiger, AP; Trotta, Ede A, 2009)
"The chloral hydrate induced increase in 3H-choline occurred also in animals with chronic septal lesions."( Atweh, SF; Kuhar, MJ, 1976)

Treatment

ExcerptReference
"In chloral hydrate treatment with/without FSS, expressions of Cu/Zn-SOD, Mn-SOD, and catalase proteins were high compared to only-melatonin treatments."( Jeung, EB; Kim, CH; Yoo, YM, 2018)
"Treatment with chloral hydrate (3 x 10(-3) M), like Kepone (10(-5) M), suppressed 2B1/2 mRNA induction following phenobarbital (10(-4) M) treatment, while Kepone alcohol (10(-5) M), which is not a gem-diol, produced less suppression."( Guzelian, PS; Kocarek, TA; Schuetz, EG, 1994)

Roles (4)

RoleDescription
xenobioticA xenobiotic (Greek, xenos "foreign"; bios "life") is a compound that is foreign to a living organism. Principal xenobiotics include: drugs, carcinogens and various compounds that have been introduced into the environment by artificial means.
sedativeA central nervous system depressant used to induce drowsiness or sleep or to reduce psychological excitement or anxiety.
general anaestheticSubstance that produces loss of consciousness.
mouse metaboliteAny mammalian metabolite produced during a metabolic reaction in a mouse (Mus musculus).
[role information is derived from Chemical Entities of Biological Interest (ChEBI), Hastings J, Owen G, Dekker A, Ennis M, Kale N, Muthukrishnan V, Turner S, Swainston N, Mendes P, Steinbeck C. (2016). ChEBI in 2016: Improved services and an expanding collection of metabolites. Nucleic Acids Res]

Drug Classes (3)

ClassDescription
ethanediolAny diol that is ethane or substituted ethane carrying two hydroxy groups.
organochlorine compoundAn organochlorine compound is a compound containing at least one carbon-chlorine bond.
aldehyde hydrateA 1,1-diol resulting from the formal addition of water to the carbonyl group of a aldehyde.
[compound class information is derived from Chemical Entities of Biological Interest (ChEBI), Hastings J, Owen G, Dekker A, Ennis M, Kale N, Muthukrishnan V, Turner S, Swainston N, Mendes P, Steinbeck C. (2016). ChEBI in 2016: Improved services and an expanding collection of metabolites. Nucleic Acids Res]

Pathways (3)

chloral hydrate is involved in 3 pathway(s), involving a total of 17 unique proteins and 103 unique compounds

PathwayProteinsCompounds
superpathway of pyrimidine deoxyribonucleosides degradation738
superpathway of purine deoxyribonucleosides degradation637
2'-deoxy-u03B1-D-ribose 1-phosphate degradation428

Protein Targets (5)

Potency Measurements

ProteinTaxonomyMeasurementAverage (µ)Min (ref.)Avg (ref.)Max (ref.)Bioassay(s)
glucocorticoid receptor [Homo sapiens]Homo sapiens (human)Potency2.39140.000214.376460.0339AID720691
retinoid X nuclear receptor alphaHomo sapiens (human)Potency5.79970.000817.505159.3239AID1159531
peroxisome proliferator-activated receptor deltaHomo sapiens (human)Potency11.88230.001024.504861.6448AID743215
peripheral myelin protein 22Rattus norvegicus (Norway rat)Potency0.00260.005612.367736.1254AID624032
lamin isoform A-delta10Homo sapiens (human)Potency11.22020.891312.067628.1838AID1487
[prepared from compound, protein, and bioassay information from National Library of Medicine (NLM), extracted Dec-2023]

Bioassays (39)

Assay IDTitleYearJournalArticle
AID1347103qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for OHS-50 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347083qHTS for Inhibitors of the Functional Ribonucleoprotein Complex (vRNP) of Lassa (LASV) Arenavirus: Viability assay - alamar blue signal for LASV Primary Screen2020Antiviral research, 01, Volume: 173A cell-based, infectious-free, platform to identify inhibitors of lassa virus ribonucleoprotein (vRNP) activity.
AID1347107qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for Rh30 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347089qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for TC32 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347106qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for control Hh wild type fibroblast cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347086qHTS for Inhibitors of the Functional Ribonucleoprotein Complex (vRNP) of Lymphocytic Choriomeningitis Arenaviruses (LCMV): LCMV Primary Screen - GLuc reporter signal2020Antiviral research, 01, Volume: 173A cell-based, infectious-free, platform to identify inhibitors of lassa virus ribonucleoprotein (vRNP) activity.
AID1347099qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for NB1643 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347098qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for SK-N-SH cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347154Primary screen GU AMC qHTS for Zika virus inhibitors2020Proceedings of the National Academy of Sciences of the United States of America, 12-08, Volume: 117, Issue:49
Therapeutic candidates for the Zika virus identified by a high-throughput screen for Zika protease inhibitors.
AID1347094qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for BT-37 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347424RapidFire Mass Spectrometry qHTS Assay for Modulators of WT P53-Induced Phosphatase 1 (WIP1)2019The Journal of biological chemistry, 11-15, Volume: 294, Issue:46
Physiologically relevant orthogonal assays for the discovery of small-molecule modulators of WIP1 phosphatase in high-throughput screens.
AID1347091qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for SJ-GBM2 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347101qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for BT-12 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347105qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for MG 63 (6-TG R) cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1296008Cytotoxic Profiling of Annotated Libraries Using Quantitative High-Throughput Screening2020SLAS discovery : advancing life sciences R & D, 01, Volume: 25, Issue:1
Cytotoxic Profiling of Annotated and Diverse Chemical Libraries Using Quantitative High-Throughput Screening.
AID1347102qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for Rh18 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1508630Primary qHTS for small molecule stabilizers of the endoplasmic reticulum resident proteome: Secreted ER Calcium Modulated Protein (SERCaMP) assay2021Cell reports, 04-27, Volume: 35, Issue:4
A target-agnostic screen identifies approved drugs to stabilize the endoplasmic reticulum-resident proteome.
AID1745845Primary qHTS for Inhibitors of ATXN expression
AID1347100qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for LAN-5 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347082qHTS for Inhibitors of the Functional Ribonucleoprotein Complex (vRNP) of Lassa (LASV) Arenavirus: LASV Primary Screen - GLuc reporter signal2020Antiviral research, 01, Volume: 173A cell-based, infectious-free, platform to identify inhibitors of lassa virus ribonucleoprotein (vRNP) activity.
AID1347095qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for NB-EBc1 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID651635Viability Counterscreen for Primary qHTS for Inhibitors of ATXN expression
AID1347090qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for DAOY cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347407qHTS to identify inhibitors of the type 1 interferon - major histocompatibility complex class I in skeletal muscle: primary screen against the NCATS Pharmaceutical Collection2020ACS chemical biology, 07-17, Volume: 15, Issue:7
High-Throughput Screening to Identify Inhibitors of the Type I Interferon-Major Histocompatibility Complex Class I Pathway in Skeletal Muscle.
AID1347096qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for U-2 OS cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347092qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for A673 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347097qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for Saos-2 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347104qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for RD cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347425Rhodamine-PBP qHTS Assay for Modulators of WT P53-Induced Phosphatase 1 (WIP1)2019The Journal of biological chemistry, 11-15, Volume: 294, Issue:46
Physiologically relevant orthogonal assays for the discovery of small-molecule modulators of WIP1 phosphatase in high-throughput screens.
AID1347093qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for SK-N-MC cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID1347108qHTS of pediatric cancer cell lines to identify multiple opportunities for drug repurposing: Primary screen for Rh41 cells2018Oncotarget, Jan-12, Volume: 9, Issue:4
Quantitative high-throughput phenotypic screening of pediatric cancer cell lines identifies multiple opportunities for drug repurposing.
AID504749qHTS profiling for inhibitors of Plasmodium falciparum proliferation2011Science (New York, N.Y.), Aug-05, Volume: 333, Issue:6043
Chemical genomic profiling for antimalarial therapies, response signatures, and molecular targets.
AID588213Literature-mined compound from Fourches et al multi-species drug-induced liver injury (DILI) dataset, effect in non-rodents2010Chemical research in toxicology, Jan, Volume: 23, Issue:1
Cheminformatics analysis of assertions mined from literature that describe drug-induced liver injury in different species.
AID409954Inhibition of mouse brain MAOA2008Journal of medicinal chemistry, Nov-13, Volume: 51, Issue:21
Quantitative structure-activity relationship and complex network approach to monoamine oxidase A and B inhibitors.
AID588212Literature-mined compound from Fourches et al multi-species drug-induced liver injury (DILI) dataset, effect in rodents2010Chemical research in toxicology, Jan, Volume: 23, Issue:1
Cheminformatics analysis of assertions mined from literature that describe drug-induced liver injury in different species.
AID588211Literature-mined compound from Fourches et al multi-species drug-induced liver injury (DILI) dataset, effect in humans2010Chemical research in toxicology, Jan, Volume: 23, Issue:1
Cheminformatics analysis of assertions mined from literature that describe drug-induced liver injury in different species.
AID1337095Inhibition of human MPO2017ACS medicinal chemistry letters, Feb-09, Volume: 8, Issue:2
From Dynamic Combinatorial Chemistry to
AID1346987P-glycoprotein substrates identified in KB-8-5-11 adenocarcinoma cell line, qHTS therapeutic library screen2019Molecular pharmacology, 11, Volume: 96, Issue:5
A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein.
AID1346986P-glycoprotein substrates identified in KB-3-1 adenocarcinoma cell line, qHTS therapeutic library screen2019Molecular pharmacology, 11, Volume: 96, Issue:5
A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein.
[information is prepared from bioassay data collected from National Library of Medicine (NLM), extracted Dec-2023]

Research

Studies (1,814)

TimeframeStudies, This Drug (%)All Drugs %
pre-19901054 (58.10)18.7374
1990's305 (16.81)18.2507
2000's214 (11.80)29.6817
2010's181 (9.98)24.3611
2020's60 (3.31)2.80
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Study Types

Publication TypeThis drug (%)All Drugs (%)
Trials146 (6.98%)5.53%
Reviews88 (4.21%)6.00%
Case Studies126 (6.03%)4.05%
Observational2 (0.10%)0.25%
Other1,729 (82.69%)84.16%
[information is prepared from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Clinical Trials (16)

Trial Overview

TrialPhaseEnrollmentStudy TypeStart DateStatus
Comparison of Oral Chloral Hydrate and Combination of Intranasal Dexmedetomidine and Ketamine for Procedural Sedation in Children: a Randomized Controlled Trial[NCT04820205]136 participants (Anticipated)Interventional2021-09-03Recruiting
[NCT01149226]100 participants (Actual)Interventional2010-05-31Completed
The Role of Melatonin in the Effective Attainment of Sleep Electroencephalograms (EEG) in Children[NCT02195661]Phase 3194 participants (Actual)Interventional2014-04-30Completed
A Qualitative Comparison of Oral Chloral Hydrate vs 2.0 or 3.0 mcg/kg Nasal Dexmedetomidine in Children Undergoing Transthoracic Echocardiography[NCT02523144]Phase 4279 participants (Actual)Interventional2014-09-30Completed
Evaluation of the Effect of Chloral Hydrate, Hydroxyzine and Melatonin Used as Sedative Drugs in EEG Recording in Children[NCT05492812]180 participants (Actual)Interventional2021-01-01Completed
Sedation to Electroencephalography With Dexmedetomidine or Chloral Hydrate: a Comparative Study of the Qualitative and Quantitative Electroencephalogram Pattern[NCT01083797]Phase 325 participants (Actual)Interventional2009-12-31Completed
[NCT02239445]Phase 4158 participants (Actual)Interventional2014-09-30Completed
Comparison of Oral Chloral Hydrate and Combination of Intranasal Dexmedetomidine and Ketamine for Rescue After Failed Pediatric Procedural Sedation: a Randomized Controlled Trial[NCT04822064]70 participants (Anticipated)Interventional2022-09-22Recruiting
Use of Chloral Hydrate to Perform Auditory Brainstem Response (ABR)[NCT00949780]Phase 241 participants (Actual)Interventional2007-10-31Completed
Evaluation of Pediatric Procedural Sedation With Rectal Chloral Hydrate or Intranasal Midazolam - a Randomized Controlled Trial[NCT01402596]Phase 20 participants (Actual)Interventional2011-08-31Withdrawn(stopped due to Institution decided on starting a new protocol of sedation, with another methods and that´s why this study has not started.)
A RANDOMIZED CONTROLLED TRIAL OF ORAL CHLORAL HYDRATE VERSUS INTRANASAL DEXMEDETOMIDINE FOR SEDATED ABR EXAMS.[NCT01255904]Phase 490 participants (Actual)Interventional2011-08-31Completed
Prospective, Double Blinded,Randomized Controlled Trial of Dexmedetomidine Versus Chloral Hydrate for Pediatric Sedation During EEG[NCT00464451]Phase 20 participants (Actual)Interventional2009-08-31Withdrawn(stopped due to Unable to obtain approval from FDA for use of chloral hydrate)
An Open-label Trial to Evaluate the Safety and Efficacy of Chloral Hydrate in Patients With Severe Insomnia[NCT06053840]Phase 4100 participants (Anticipated)Interventional2023-09-21Recruiting
Pharmacotoxicology of Trichloroethylene Metabolites Aim 3[NCT01128270]Phase 1/Phase 227 participants (Actual)Interventional2010-04-30Completed
Pharmacovigilance in Gerontopsychiatric Patients[NCT02374567]Phase 3407 participants (Actual)Interventional2015-01-31Terminated
Effects Comparison Between Oral and Enema of Chloral Hydrate in Pediatric Ophthalmic Examination[NCT03242629]120 participants (Actual)Interventional2017-01-31Completed
[information is prepared from clinicaltrials.gov, extracted Sep-2024]

Trial Outcomes

Time to Complete Study

Time from medication administration to study completion. (NCT01255904)
Timeframe: 60-180 minutes

InterventionMinutes (Median)
Oral Placebo and Intransal Dexmedetomidine85.5
Oral Chloral Hydrate and Intranasal Placebo110

Detectable DCA After Day 1 in Serum (0=No 1=Yes)

All four arms receive Chloral Hydrate on Day 1 (arms 1A and 1B environmental levels) and (arms 2A and 2B therapeutic levels). The question is could Dichloroacetate be detected in serum at the end of day 1. This analysis is purely descriptive, and no comparisons were planned. (NCT01128270)
Timeframe: 1 day

Interventionparticipants (Number)
Environmental Chloral Hydrate and DCA (1A)0
Environmental Chloral Hydrate (1B)0
Therapeutic Chloral Hydrate and DCA (2A)0
Therapeutic Chloral Hydrate (2B)0

Difference in Half Lives 5 Day Less One Day Exposure in Trichloroacetate

Elimination Half-life Difference on Arm 2B for 13C-Labeled trichloroacetate between day 5 (prolonged exposure) and day 1 (de novo exposure) after therapeutic level exposure to Chloral Hydrate. This outcome only applies to Period 4. Trichloroacetate is a marker, not an intervention. (NCT01128270)
Timeframe: 5 days

Interventionminutes (Mean)
Therapeutic Chloral Hydrate (2B)2432

Plasma DCA (Microgram/ml) After 5 Days of Therapeutic Level Chloral Hydrate on Arm 2A.

After 5 days of of therapeutic level Chloral Hydrate, the levels of Dichloroacetate in the plasma were measured. (NCT01128270)
Timeframe: 6 Days

Interventionmicrograms/ml (Mean)
Therapeutic Chloral Hydrate and DCA (2A)1.64

Urinary Maleylacetone Levels After 5 Day Exposure to Therapeutic Chloral Hydrate (Arm 2B)

The levels were clinically indetectable at baseline and the question was whether or not substantive levels would be noted at after 5 days exposure to Chloral Hydrate. Detectable, but low levels were detected. (NCT01128270)
Timeframe: 5 days

Interventionmicrograms per ml clorohydrate (Mean)
Therapeutic Chloral Hydrate (2B)0.38

SubstanceDescriptionRelationhip StrengthStudiesTrialsClassesRoles
quinacrine[no description available]high30acridines;
aromatic ether;
organochlorine compound;
tertiary amino compound		antimalarial;
EC 1.8.1.12 (trypanothione-disulfide reductase) inhibitor
chlordecone[no description available]high20cyclic ketone;
organochlorine compound		insecticide;
persistent organic pollutant
aminocaproic acid[no description available]medium30amino acid zwitterion;
epsilon-amino acid;
omega-amino fatty acid		antifibrinolytic drug;
hematologic agent;
metabolite
5,6-dimethylbenzimidazole[no description available]medium10dimethylbenzimidazoleEscherichia coli metabolite;
human metabolite
hexachlorocyclohexane[no description available]medium10chlorocyclohexane
parathion[no description available]high20C-nitro compound;
organic thiophosphate;
organothiophosphate insecticide		acaricide;
agrochemical;
avicide;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
EC 3.1.1.8 (cholinesterase) inhibitor;
mouse metabolite
pentachlorophenol[no description available]medium10aromatic fungicide;
chlorophenol;
organochlorine pesticide;
pentachlorobenzenes		human xenobiotic metabolite
pyrazinamide[no description available]medium20monocarboxylic acid amide;
N-acylammonia;
pyrazines		antitubercular agent;
prodrug
amitrole[no description available]medium10aromatic amine;
triazoles		carotenoid biosynthesis inhibitor;
EC 1.11.1.6 (catalase) inhibitor;
herbicide
phenytoin[no description available]medium230imidazolidine-2,4-dioneanticonvulsant;
drug allergen;
sodium channel blocker;
teratogenic agent
phenytoin[no description available]medium231imidazolidine-2,4-dioneanticonvulsant;
drug allergen;
sodium channel blocker;
teratogenic agent
acebutolol[no description available]medium20aromatic amide;
ethanolamines;
ether;
monocarboxylic acid amide;
propanolamine;
secondary amino compound		anti-arrhythmia drug;
antihypertensive agent;
beta-adrenergic antagonist;
sympathomimetic agent
acetaminophen[no description available]high306acetamides;
phenols		antipyretic;
cyclooxygenase 1 inhibitor;
cyclooxygenase 2 inhibitor;
cyclooxygenase 3 inhibitor;
environmental contaminant;
ferroptosis inducer;
geroprotector;
hepatotoxic agent;
human blood serum metabolite;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
xenobiotic
acetaminophen[no description available]high300acetamides;
phenols		antipyretic;
cyclooxygenase 1 inhibitor;
cyclooxygenase 2 inhibitor;
cyclooxygenase 3 inhibitor;
environmental contaminant;
ferroptosis inducer;
geroprotector;
hepatotoxic agent;
human blood serum metabolite;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
xenobiotic
acetazolamide[no description available]medium70monocarboxylic acid amide;
sulfonamide;
thiadiazoles		anticonvulsant;
diuretic;
EC 4.2.1.1 (carbonic anhydrase) inhibitor
acetohexamide[no description available]medium20acetophenones;
N-sulfonylurea		hypoglycemic agent;
insulin secretagogue
albuterol[no description available]high31phenols;
phenylethanolamines;
secondary amino compound		beta-adrenergic agonist;
bronchodilator agent;
environmental contaminant;
xenobiotic
albuterol[no description available]high30phenols;
phenylethanolamines;
secondary amino compound		beta-adrenergic agonist;
bronchodilator agent;
environmental contaminant;
xenobiotic
altretamine[no description available]medium10triamino-1,3,5-triazine
amantadine[no description available]medium20adamantanes;
primary aliphatic amine		analgesic;
antiparkinson drug;
antiviral drug;
dopaminergic agent;
NMDA receptor antagonist;
non-narcotic analgesic
ametantrone[no description available]medium10
aminoglutethimide[no description available]medium30dicarboximide;
piperidones;
substituted aniline		adrenergic agent;
anticonvulsant;
antineoplastic agent;
EC 1.14.14.14 (aromatase) inhibitor
theophylline[no description available]medium60dimethylxanthineadenosine receptor antagonist;
anti-asthmatic drug;
anti-inflammatory agent;
bronchodilator agent;
drug metabolite;
EC 3.1.4.* (phosphoric diester hydrolase) inhibitor;
fungal metabolite;
human blood serum metabolite;
immunomodulator;
muscle relaxant;
vasodilator agent
2-aminothiazole[no description available]medium101,3-thiazoles;
primary amino compound
amlodipine[no description available]medium20dihydropyridine;
ethyl ester;
methyl ester;
monochlorobenzenes;
primary amino compound		antihypertensive agent;
calcium channel blocker;
vasodilator agent
aspirin[no description available]medium90benzoic acids;
phenyl acetates;
salicylates		anticoagulant;
antipyretic;
cyclooxygenase 1 inhibitor;
cyclooxygenase 2 inhibitor;
drug allergen;
EC 1.1.1.188 (prostaglandin-F synthase) inhibitor;
geroprotector;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
plant activator;
platelet aggregation inhibitor;
prostaglandin antagonist;
teratogenic agent
atenolol[no description available]medium20ethanolamines;
monocarboxylic acid amide;
propanolamine		anti-arrhythmia drug;
antihypertensive agent;
beta-adrenergic antagonist;
environmental contaminant;
sympatholytic agent;
xenobiotic
azathioprine[no description available]medium20aryl sulfide;
C-nitro compound;
imidazoles;
thiopurine		antimetabolite;
antineoplastic agent;
carcinogenic agent;
DNA synthesis inhibitor;
hepatotoxic agent;
immunosuppressive agent;
prodrug
azinphosmethyl[no description available]medium10benzotriazines;
organic thiophosphate;
organothiophosphate insecticide		agrochemical;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
EC 3.1.1.8 (cholinesterase) inhibitor
betaxolol[no description available]medium10propanolamineantihypertensive agent;
beta-adrenergic antagonist;
sympatholytic agent
bisoprolol[no description available]medium20secondary alcohol;
secondary amine		anti-arrhythmia drug;
antihypertensive agent;
beta-adrenergic antagonist;
sympatholytic agent
bromhexine[no description available]medium10organobromine compound;
substituted aniline;
tertiary amino compound		mucolytic
bumetanide[no description available]medium20amino acid;
benzoic acids;
sulfonamide		diuretic;
EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor
bupivacaine[no description available]medium40aromatic amide;
piperidinecarboxamide;
tertiary amino compound
busulfan[no description available]medium20methanesulfonate esteralkylating agent;
antineoplastic agent;
carcinogenic agent;
insect sterilant;
teratogenic agent
caffeine[no description available]high290purine alkaloid;
trimethylxanthine		adenosine A2A receptor antagonist;
adenosine receptor antagonist;
adjuvant;
central nervous system stimulant;
diuretic;
EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor;
EC 3.1.4.* (phosphoric diester hydrolase) inhibitor;
environmental contaminant;
food additive;
fungal metabolite;
geroprotector;
human blood serum metabolite;
mouse metabolite;
mutagen;
plant metabolite;
psychotropic drug;
ryanodine receptor agonist;
xenobiotic
carbazilquinone[no description available]medium10organic molecular entity
carmofur[no description available]medium10organohalogen compound;
pyrimidines
carmustine[no description available]medium20N-nitrosoureas;
organochlorine compound		alkylating agent;
antineoplastic agent
carteolol[no description available]medium10quinolone;
secondary alcohol		anti-arrhythmia drug;
antiglaucoma drug;
antihypertensive agent;
beta-adrenergic antagonist;
sympatholytic agent
celiprolol[no description available]medium10aromatic ketone
chlorambucil[no description available]high30aromatic amine;
monocarboxylic acid;
nitrogen mustard;
organochlorine compound;
tertiary amino compound		alkylating agent;
antineoplastic agent;
carcinogenic agent;
drug allergen;
immunosuppressive agent
chloroquine[no description available]medium20aminoquinoline;
organochlorine compound;
secondary amino compound;
tertiary amino compound		anticoronaviral agent;
antimalarial;
antirheumatic drug;
autophagy inhibitor;
dermatologic drug
chlorothiazide[no description available]medium10benzothiadiazineantihypertensive agent;
diuretic
chlorpropamide[no description available]medium20monochlorobenzenes;
N-sulfonylurea		hypoglycemic agent;
insulin secretagogue
chlorthalidone[no description available]medium10isoindoles;
monochlorobenzenes;
sulfonamide
cimetidine[no description available]medium20aliphatic sulfide;
guanidines;
imidazoles;
nitrile		adjuvant;
analgesic;
anti-ulcer drug;
H2-receptor antagonist;
P450 inhibitor
clenbuterol[no description available]medium10amino alcohol;
dichlorobenzene;
ethanolamines;
primary arylamine;
secondary amino compound;
substituted aniline		beta-adrenergic agonist;
bronchodilator agent;
sympathomimetic agent
clioquinol[no description available]medium20monohydroxyquinoline;
organochlorine compound;
organoiodine compound		antibacterial agent;
antifungal agent;
antimicrobial agent;
antineoplastic agent;
antiprotozoal drug;
chelator;
copper chelator
cycloleucine[no description available]medium10non-proteinogenic alpha-amino acidEC 2.5.1.6 (methionine adenosyltransferase) inhibitor
dapsone[no description available]medium20substituted aniline;
sulfone		anti-inflammatory drug;
antiinfective agent;
antimalarial;
leprostatic drug
debrisoquin[no description available]medium10carboxamidine;
isoquinolines		adrenergic agent;
antihypertensive agent;
human metabolite;
sympatholytic agent
diazoxide[no description available]high30benzothiadiazine;
organochlorine compound;
sulfone		antihypertensive agent;
beta-adrenergic agonist;
bronchodilator agent;
cardiotonic drug;
diuretic;
K-ATP channel agonist;
sodium channel blocker;
sympathomimetic agent;
vasodilator agent
dicamba[no description available]medium10dichlorobenzene;
methoxybenzoic acid		agrochemical;
environmental contaminant;
herbicide;
synthetic auxin;
xenobiotic
dichlorphenamide[no description available]medium10dichlorobenzene;
sulfonamide		antiglaucoma drug;
EC 4.2.1.1 (carbonic anhydrase) inhibitor;
ophthalmology drug
dicyclomine[no description available]medium10carboxylic ester;
tertiary amine		antispasmodic drug;
muscarinic antagonist;
parasympatholytic
diethylcarbamazine[no description available]medium10N-carbamoylpiperazine;
N-methylpiperazine
diflunisal[no description available]medium20monohydroxybenzoic acid;
organofluorine compound		non-narcotic analgesic;
non-steroidal anti-inflammatory drug
dimercaprol[no description available]medium20dithiol;
primary alcohol		chelator
dinitolmide[no description available]medium10dinitrotoluene
dipyridamole[no description available]medium20piperidines;
pyrimidopyrimidine;
tertiary amino compound;
tetrol		adenosine phosphodiesterase inhibitor;
EC 3.5.4.4 (adenosine deaminase) inhibitor;
platelet aggregation inhibitor;
vasodilator agent
dipyrone[no description available]medium10amino sulfonic acid;
pyrazoles		anti-inflammatory agent;
antipyretic;
antirheumatic drug;
cyclooxygenase 3 inhibitor;
non-narcotic analgesic;
peripheral nervous system drug;
prodrug
disopyramide[no description available]medium20monocarboxylic acid amide;
pyridines;
tertiary amino compound		anti-arrhythmia drug
disulfiram[no description available]medium150organic disulfide;
organosulfur acaricide		angiogenesis inhibitor;
antineoplastic agent;
apoptosis inducer;
EC 1.2.1.3 [aldehyde dehydrogenase (NAD(+))] inhibitor;
EC 3.1.1.1 (carboxylesterase) inhibitor;
EC 3.1.1.8 (cholinesterase) inhibitor;
EC 5.99.1.2 (DNA topoisomerase) inhibitor;
ferroptosis inducer;
fungicide;
NF-kappaB inhibitor
valproic acid[no description available]medium70branched-chain fatty acid;
branched-chain saturated fatty acid		anticonvulsant;
antimanic drug;
EC 3.5.1.98 (histone deacetylase) inhibitor;
GABA agent;
neuroprotective agent;
psychotropic drug;
teratogenic agent
domperidone[no description available]medium10benzimidazoles;
heteroarylpiperidine		antiemetic;
dopaminergic antagonist
ethinamate[no description available]medium30carbamate ester;
terminal acetylenic compound		sedative
ethosuximide[no description available]medium40dicarboximide;
pyrrolidinone		anticonvulsant;
geroprotector;
T-type calcium channel blocker
felodipine[no description available]medium20dichlorobenzene;
dihydropyridine;
ethyl ester;
methyl ester		anti-arrhythmia drug;
antihypertensive agent;
calcium channel blocker;
vasodilator agent
berotek[no description available]medium10resorcinols;
secondary alcohol;
secondary amino compound		beta-adrenergic agonist;
bronchodilator agent;
sympathomimetic agent;
tocolytic agent
flecainide[no description available]medium20aromatic ether;
monocarboxylic acid amide;
organofluorine compound;
piperidines		anti-arrhythmia drug
flucytosine[no description available]medium20aminopyrimidine;
nucleoside analogue;
organofluorine compound;
pyrimidine antifungal drug;
pyrimidone		prodrug
fluphenazine[no description available]medium40N-alkylpiperazine;
organofluorine compound;
phenothiazines		anticoronaviral agent;
dopaminergic antagonist;
phenothiazine antipsychotic drug
fluphenazine[no description available]medium41N-alkylpiperazine;
organofluorine compound;
phenothiazines		anticoronaviral agent;
dopaminergic antagonist;
phenothiazine antipsychotic drug
fluorouracil[no description available]high30nucleobase analogue;
organofluorine compound		antimetabolite;
antineoplastic agent;
environmental contaminant;
immunosuppressive agent;
radiosensitizing agent;
xenobiotic
flutamide[no description available]medium20(trifluoromethyl)benzenes;
monocarboxylic acid amide		androgen antagonist;
antineoplastic agent
furosemide[no description available]high50chlorobenzoic acid;
furans;
sulfonamide		environmental contaminant;
loop diuretic;
xenobiotic
gemfibrozil[no description available]medium20aromatic etherantilipemic drug
glutethimide[no description available]medium480piperidines
glutethimide[no description available]medium483piperidines
glyburide[no description available]medium20monochlorobenzenes;
N-sulfonylurea		anti-arrhythmia drug;
EC 2.7.1.33 (pantothenate kinase) inhibitor;
EC 3.6.3.49 (channel-conductance-controlling ATPase) inhibitor;
hypoglycemic agent
guanethidine[no description available]medium20azocanes;
guanidines		adrenergic antagonist;
antihypertensive agent;
sympatholytic agent
halothane[no description available]high430haloalkane;
organobromine compound;
organochlorine compound;
organofluorine compound		inhalation anaesthetic
hydralazine[no description available]medium30azaarene;
hydrazines;
ortho-fused heteroarene;
phthalazines		antihypertensive agent;
vasodilator agent
hydrochlorothiazide[no description available]high20benzothiadiazine;
organochlorine compound;
sulfonamide		antihypertensive agent;
diuretic;
environmental contaminant;
xenobiotic
hydroxyurea[no description available]medium20one-carbon compound;
ureas		antimetabolite;
antimitotic;
antineoplastic agent;
DNA synthesis inhibitor;
EC 1.17.4.1 (ribonucleoside-diphosphate reductase) inhibitor;
genotoxin;
immunomodulator;
radical scavenger;
teratogenic agent
ibuprofen[no description available]high30monocarboxylic acidantipyretic;
cyclooxygenase 1 inhibitor;
cyclooxygenase 2 inhibitor;
drug allergen;
environmental contaminant;
geroprotector;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
radical scavenger;
xenobiotic
phenelzine[no description available]medium50primary amine
lidocaine[no description available]high170benzenes;
monocarboxylic acid amide;
tertiary amino compound		anti-arrhythmia drug;
drug allergen;
environmental contaminant;
local anaesthetic;
xenobiotic
amrinone[no description available]medium20bipyridinesEC 3.1.4.* (phosphoric diester hydrolase) inhibitor
indapamide[no description available]medium20indoles;
organochlorine compound;
sulfonamide		antihypertensive agent;
diuretic
iproniazid[no description available]medium60carbohydrazide;
pyridines
isoniazid[no description available]medium60carbohydrazideantitubercular agent;
drug allergen
isoproterenol[no description available]medium100catechols;
secondary alcohol;
secondary amino compound		beta-adrenergic agonist;
bronchodilator agent;
cardiotonic drug;
sympathomimetic agent
isoproterenol[no description available]medium101catechols;
secondary alcohol;
secondary amino compound		beta-adrenergic agonist;
bronchodilator agent;
cardiotonic drug;
sympathomimetic agent
labetalol[no description available]medium20benzamides;
benzenes;
phenols;
primary carboxamide;
salicylamides;
secondary alcohol;
secondary amino compound
lomustine[no description available]medium20N-nitrosoureas;
organochlorine compound		alkylating agent;
antineoplastic agent
mechlorethamine[no description available]high40nitrogen mustard;
organochlorine compound		alkylating agent
mephenytoin[no description available]medium20imidazolidine-2,4-dioneanticonvulsant
mepivacaine[no description available]medium40piperidinecarboxamidedrug allergen;
local anaesthetic
meprobamate[no description available]medium380organic molecular entity
methoxyflurane[no description available]high120ether;
organochlorine compound;
organofluorine compound		hepatotoxic agent;
inhalation anaesthetic;
nephrotoxic agent;
non-narcotic analgesic
methyclothiazide[no description available]medium10benzothiadiazine
methyl salicylate[no description available]medium20benzoate ester;
methyl ester;
salicylates		flavouring agent;
insect attractant;
metabolite
methylphenidate[no description available]medium90beta-amino acid ester;
methyl ester;
piperidines
metoclopramide[no description available]medium20benzamides;
monochlorobenzenes;
substituted aniline;
tertiary amino compound		antiemetic;
dopaminergic antagonist;
environmental contaminant;
gastrointestinal drug;
xenobiotic
metronidazole[no description available]high40C-nitro compound;
imidazoles;
primary alcohol		antiamoebic agent;
antibacterial drug;
antimicrobial agent;
antiparasitic agent;
antitrichomonal drug;
environmental contaminant;
prodrug;
radiosensitizing agent;
xenobiotic
mexiletine[no description available]medium10aromatic ether;
primary amino compound		anti-arrhythmia drug
minoxidil[no description available]medium20dialkylarylamine;
tertiary amino compound
mitoxantrone[no description available]medium20dihydroxyanthraquinoneanalgesic;
antineoplastic agent
moclobemide[no description available]medium10benzamides;
monochlorobenzenes;
morpholines		antidepressant;
environmental contaminant;
xenobiotic
clorgyline[no description available]medium10aromatic ether;
dichlorobenzene;
terminal acetylenic compound;
tertiary amino compound		antidepressant;
EC 1.4.3.4 (monoamine oxidase) inhibitor
nalidixic acid[no description available]medium301,8-naphthyridine derivative;
monocarboxylic acid;
quinolone antibiotic		antibacterial drug;
antimicrobial agent;
DNA synthesis inhibitor
nifedipine[no description available]medium20C-nitro compound;
dihydropyridine;
methyl ester		calcium channel blocker;
human metabolite;
tocolytic agent;
vasodilator agent
nimodipine[no description available]medium202-methoxyethyl ester;
C-nitro compound;
dicarboxylic acids and O-substituted derivatives;
diester;
dihydropyridine;
isopropyl ester		antihypertensive agent;
calcium channel blocker;
cardiovascular drug;
vasodilator agent
nitrendipine[no description available]medium20C-nitro compound;
dicarboxylic acids and O-substituted derivatives;
diester;
dihydropyridine;
ethyl ester;
methyl ester		antihypertensive agent;
calcium channel blocker;
geroprotector;
vasodilator agent
nitroglycerin[no description available]high80nitroglycerolexplosive;
muscle relaxant;
nitric oxide donor;
prodrug;
tocolytic agent;
vasodilator agent;
xenobiotic
nylidrin[no description available]medium10alkylbenzene
oxprenolol[no description available]medium30aromatic ether
4-dichlorobenzene[no description available]medium10dichlorobenzeneinsecticide
pentamidine[no description available]high20aromatic ether;
carboxamidine;
diether		anti-inflammatory agent;
antifungal agent;
calmodulin antagonist;
chemokine receptor 5 antagonist;
EC 2.3.1.48 (histone acetyltransferase) inhibitor;
NMDA receptor antagonist;
S100 calcium-binding protein B inhibitor;
trypanocidal drug;
xenobiotic
perphenazine[no description available]high50N-(2-hydroxyethyl)piperazine;
N-alkylpiperazine;
organochlorine compound;
phenothiazines		antiemetic;
dopaminergic antagonist;
phenothiazine antipsychotic drug
phenacemide[no description available]medium10acetamides
phenacetin[no description available]medium50acetamides;
aromatic ether		cyclooxygenase 3 inhibitor;
non-narcotic analgesic;
peripheral nervous system drug
phenazopyridine[no description available]medium10diaminopyridine;
monoazo compound		anticoronaviral agent;
carcinogenic agent;
local anaesthetic;
non-narcotic analgesic
phenobarbital[no description available]high793barbituratesanticonvulsant;
drug allergen;
excitatory amino acid antagonist;
sedative
phenobarbital[no description available]high790barbituratesanticonvulsant;
drug allergen;
excitatory amino acid antagonist;
sedative
phentermine[no description available]medium10primary amineadrenergic agent;
appetite depressant;
central nervous system drug;
central nervous system stimulant;
dopaminergic agent;
sympathomimetic agent
pipobroman[no description available]medium10N-acylpiperazine;
organobromine compound;
tertiary carboxamide		alkylating agent;
antineoplastic agent
polythiazide[no description available]medium10benzothiadiazine
prilocaine[no description available]medium20amino acid amide;
monocarboxylic acid amide		anticonvulsant;
local anaesthetic
primaquine[no description available]medium20aminoquinoline;
aromatic ether;
N-substituted diamine		antimalarial
primidone[no description available]high50pyrimidoneanticonvulsant;
environmental contaminant;
xenobiotic
probenecid[no description available]medium60benzoic acids;
sulfonamide		uricosuric drug
probucol[no description available]medium20dithioketal;
polyphenol		anti-inflammatory drug;
anticholesteremic drug;
antilipemic drug;
antioxidant;
cardiovascular drug
procainamide[no description available]medium40benzamidesanti-arrhythmia drug;
platelet aggregation inhibitor;
sodium channel blocker
procaine[no description available]medium170benzoate ester;
substituted aniline;
tertiary amino compound		central nervous system depressant;
drug allergen;
local anaesthetic;
peripheral nervous system drug
procarbazine[no description available]medium20benzamides;
hydrazines		antineoplastic agent
ranitidine[no description available]medium20aralkylamine
resorcinol[no description available]medium30benzenediol;
phenolic donor;
resorcinols		erythropoietin inhibitor;
sensitiser
semustine[no description available]medium10N-nitrosoureas;
organochlorine compound		alkylating agent;
antineoplastic agent;
carcinogenic agent
sulfadiazine[no description available]medium20pyrimidines;
substituted aniline;
sulfonamide antibiotic;
sulfonamide		antiinfective agent;
antimicrobial agent;
antiprotozoal drug;
coccidiostat;
drug allergen;
EC 1.1.1.153 [sepiapterin reductase (L-erythro-7,8-dihydrobiopterin forming)] inhibitor;
EC 2.5.1.15 (dihydropteroate synthase) inhibitor;
environmental contaminant;
xenobiotic
streptonigrin[no description available]medium10pyridines;
quinolone		antimicrobial agent;
antineoplastic agent
sulfacetamide[no description available]medium10N-sulfonylcarboxamide;
substituted aniline		antibacterial drug;
antiinfective agent;
antimicrobial agent;
EC 2.5.1.15 (dihydropteroate synthase) inhibitor
sulfaguanidine[no description available]medium10sulfonamide antibioticantiinfective agent
sulfamethazine[no description available]medium20pyrimidines;
sulfonamide antibiotic;
sulfonamide		antibacterial drug;
antiinfective agent;
antimicrobial agent;
carcinogenic agent;
drug allergen;
EC 2.5.1.15 (dihydropteroate synthase) inhibitor;
environmental contaminant;
ligand;
xenobiotic
sulfamethoxazole[no description available]high30isoxazoles;
substituted aniline;
sulfonamide antibiotic;
sulfonamide		antibacterial agent;
antiinfective agent;
antimicrobial agent;
drug allergen;
EC 1.1.1.153 [sepiapterin reductase (L-erythro-7,8-dihydrobiopterin forming)] inhibitor;
EC 2.5.1.15 (dihydropteroate synthase) inhibitor;
environmental contaminant;
epitope;
P450 inhibitor;
xenobiotic
sulfamethoxypyridazine[no description available]medium10pyridazines;
sulfonamide antibiotic;
sulfonamide		antiinfective agent;
drug allergen;
EC 2.5.1.15 (dihydropteroate synthase) inhibitor
sulfanilamide[no description available]medium40substituted aniline;
sulfonamide antibiotic;
sulfonamide		antibacterial agent;
drug allergen;
EC 4.2.1.1 (carbonic anhydrase) inhibitor
sulfapyridine[no description available]medium20pyridines;
substituted aniline;
sulfonamide antibiotic;
sulfonamide		antiinfective agent;
dermatologic drug;
drug allergen;
environmental contaminant;
xenobiotic
sulfasalazine[no description available]medium20
sulfathiazole[no description available]medium101,3-thiazoles;
substituted aniline;
sulfonamide antibiotic;
sulfonamide		antiinfective agent;
drug allergen;
EC 2.5.1.15 (dihydropteroate synthase) inhibitor;
environmental contaminant;
xenobiotic
sulfisoxazole[no description available]medium20isoxazoles;
sulfonamide antibiotic;
sulfonamide		antibacterial drug;
drug allergen
sulfoxone[no description available]medium10sulfonamide
tegafur[no description available]medium20organohalogen compound;
pyrimidines
terbutaline[no description available]medium20phenylethanolamines;
resorcinols		anti-asthmatic drug;
beta-adrenergic agonist;
bronchodilator agent;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
hypoglycemic agent;
sympathomimetic agent;
tocolytic agent
tetracaine[no description available]medium50benzoate ester;
tertiary amino compound		local anaesthetic
thiabendazole[no description available]medium1701,3-thiazoles;
benzimidazole fungicide;
benzimidazoles		antifungal agrochemical;
antinematodal drug
2,2'-thiodiethanol[no description available]medium10aliphatic sulfide;
diol		antineoplastic agent;
antioxidant;
metabolite;
solvent
thiotepa[no description available]medium20aziridines
tolazamide[no description available]medium20N-sulfonylureahypoglycemic agent;
potassium channel blocker
tolbutamide[no description available]medium70N-sulfonylureahuman metabolite;
hypoglycemic agent;
insulin secretagogue;
potassium channel blocker
triamterene[no description available]medium10pteridinesdiuretic;
sodium channel blocker
trichlormethiazide[no description available]medium10benzothiadiazine;
sulfonamide antibiotic		antihypertensive agent;
diuretic
2,2',2''-trichlorotriethylamine[no description available]medium10
trimethadione[no description available]medium30oxazolidinoneanticonvulsant;
geroprotector
trimethoprim[no description available]medium20aminopyrimidine;
methoxybenzenes		antibacterial drug;
diuretic;
drug allergen;
EC 1.5.1.3 (dihydrofolate reductase) inhibitor;
environmental contaminant;
xenobiotic
trimetrexate[no description available]medium10
urethane[no description available]medium700carbamate esterfungal metabolite;
mutagen
urethane[no description available]medium701carbamate esterfungal metabolite;
mutagen
vesamicol[no description available]medium10piperidines
reserpine[no description available]high262alkaloid ester;
methyl ester;
yohimban alkaloid		adrenergic uptake inhibitor;
antihypertensive agent;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
environmental contaminant;
first generation antipsychotic;
plant metabolite;
xenobiotic
reserpine[no description available]high260alkaloid ester;
methyl ester;
yohimban alkaloid		adrenergic uptake inhibitor;
antihypertensive agent;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
environmental contaminant;
first generation antipsychotic;
plant metabolite;
xenobiotic
floxuridine[no description available]medium20nucleoside analogue;
organofluorine compound;
pyrimidine 2'-deoxyribonucleoside		antimetabolite;
antineoplastic agent;
antiviral drug;
radiosensitizing agent
triethylenemelamine[no description available]medium101,3,5-triazinesalkylating agent;
insect sterilant
allobarbital[no description available]medium20barbiturates
penicillamine[no description available]medium30non-proteinogenic alpha-amino acid;
penicillamine		antirheumatic drug;
chelator;
copper chelator;
drug allergen
paramethasone[no description available]medium10fluorinated steroid
azauridine[no description available]medium10N-glycosyl-1,2,4-triazineantimetabolite;
antineoplastic agent;
drug metabolite
penicillin g[no description available]medium20penicillin allergen;
penicillin		antibacterial drug;
drug allergen;
epitope
idoxuridine[no description available]medium10organoiodine compound;
pyrimidine 2'-deoxyribonucleoside		antiviral drug;
DNA synthesis inhibitor
chloramphenicol[no description available]high50C-nitro compound;
carboxamide;
diol;
organochlorine compound		antibacterial drug;
antimicrobial agent;
Escherichia coli metabolite;
geroprotector;
Mycoplasma genitalium metabolite;
protein synthesis inhibitor
vincristine[no description available]medium20acetate ester;
formamides;
methyl ester;
organic heteropentacyclic compound;
organic heterotetracyclic compound;
tertiary alcohol;
tertiary amino compound;
vinca alkaloid		antineoplastic agent;
drug;
microtubule-destabilising agent;
plant metabolite;
tubulin modulator
physostigmine[no description available]medium100carbamate ester;
indole alkaloid		antidote to curare poisoning;
EC 3.1.1.8 (cholinesterase) inhibitor;
miotic
dromostanolone[no description available]medium1017beta-hydroxy steroid;
3-oxo-5alpha-steroid;
anabolic androgenic steroid		anabolic agent;
antineoplastic agent
cephalothin[no description available]medium20azabicycloalkene;
beta-lactam antibiotic allergen;
carboxylic acid;
cephalosporin;
semisynthetic derivative;
thiophenes		antibacterial drug;
antimicrobial agent
bromodeoxyuridine[no description available]medium30pyrimidine 2'-deoxyribonucleosideantimetabolite;
antineoplastic agent
thiamine[no description available]medium10organic chloride salt;
vitamin B1
levodopa[no description available]high100amino acid zwitterion;
dopa;
L-tyrosine derivative;
non-proteinogenic L-alpha-amino acid		allelochemical;
antidyskinesia agent;
antiparkinson drug;
dopaminergic agent;
hapten;
human metabolite;
mouse metabolite;
neurotoxin;
plant growth retardant;
plant metabolite;
prodrug
methicillin[no description available]medium20penicillin allergen;
penicillin		antibacterial drug
niridazole[no description available]medium201,3-thiazoles;
C-nitro compound
cloxacillin[no description available]medium10penicillin allergen;
penicillin;
semisynthetic derivative		antibacterial agent;
antibacterial drug
zoxazolamine[no description available]medium40benzoxazole
aniline[no description available]medium10anilines;
primary arylamine
colchicine[no description available]medium370alkaloid;
colchicine		anti-inflammatory agent;
gout suppressant;
mutagen
uracil mustard[no description available]medium10aminouracil;
nitrogen mustard
oxacillin[no description available]medium10penicillinantibacterial agent;
antibacterial drug
cycloheximide[no description available]medium50antibiotic fungicide;
cyclic ketone;
dicarboximide;
piperidine antibiotic;
piperidones;
secondary alcohol		anticoronaviral agent;
bacterial metabolite;
ferroptosis inhibitor;
neuroprotective agent;
protein synthesis inhibitor
fluocinolone acetonide[no description available]medium1011beta-hydroxy steroid;
20-oxo steroid;
21-hydroxy steroid;
3-oxo-Delta(1),Delta(4)-steroid;
cyclic ketal;
fluorinated steroid;
glucocorticoid;
organic heteropentacyclic compound;
primary alpha-hydroxy ketone		anti-inflammatory drug;
antipruritic drug
triaziquone[no description available]medium101,4-benzoquinones;
aziridines		alkylating agent;
antineoplastic agent
ampicillin[no description available]medium30beta-lactam antibiotic;
penicillin allergen;
penicillin		antibacterial drug
mannitol[no description available]medium20mannitolallergen;
antiglaucoma drug;
compatible osmolytes;
Escherichia coli metabolite;
food anticaking agent;
food bulking agent;
food humectant;
food stabiliser;
food thickening agent;
hapten;
metabolite;
osmotic diuretic;
sweetening agent
cytarabine[no description available]medium20beta-D-arabinoside;
monosaccharide derivative;
pyrimidine nucleoside		antimetabolite;
antineoplastic agent;
antiviral agent;
immunosuppressive agent
trifluridine[no description available]medium10nucleoside analogue;
organofluorine compound;
pyrimidine 2'-deoxyribonucleoside		antimetabolite;
antineoplastic agent;
antiviral drug;
EC 2.1.1.45 (thymidylate synthase) inhibitor
sulfobromophthalein sodium[no description available]medium10organic sodium saltdye
dalapon[no description available]medium10carboxylic acid;
organohalogen compound
methylpentynol[no description available]medium10ynone
methylprednisolone[no description available]high316-methylprednisolone;
primary alpha-hydroxy ketone;
tertiary alpha-hydroxy ketone		adrenergic agent;
anti-inflammatory drug;
antiemetic;
environmental contaminant;
neuroprotective agent;
xenobiotic
methylprednisolone[no description available]high306-methylprednisolone;
primary alpha-hydroxy ketone;
tertiary alpha-hydroxy ketone		adrenergic agent;
anti-inflammatory drug;
antiemetic;
environmental contaminant;
neuroprotective agent;
xenobiotic
penicillin v[no description available]medium10penicillin allergen;
penicillin
isosorbide dinitrate[no description available]medium30glucitol derivative;
nitrate ester		nitric oxide donor;
vasodilator agent
pseudoephedrine[no description available]medium10phenylethanolamines;
secondary alcohol;
secondary amino compound		anti-asthmatic drug;
bronchodilator agent;
central nervous system drug;
nasal decongestant;
plant metabolite;
sympathomimetic agent;
vasoconstrictor agent;
xenobiotic
fenoprop[no description available]medium10monocarboxylic acidphenoxy herbicide
2-methyl-4-chlorophenoxyacetic acid[no description available]medium10chlorophenoxyacetic acid;
monochlorobenzenes		environmental contaminant;
phenoxy herbicide;
synthetic auxin
dicloran[no description available]medium10aromatic fungicide;
dichlorobenzene;
nitroaniline		antifungal agrochemical
phenylhydrazine[no description available]medium10phenylhydrazinesxenobiotic
dyrene[no description available]medium10monochlorobenzenes;
organochlorine pesticide;
secondary amino compound;
triazines		antifungal agrochemical
acrolein[no description available]medium20enalherbicide;
human xenobiotic metabolite;
toxin
tetraethylenepentamine[no description available]medium10polyazaalkanecopper chelator
ergotamine[no description available]medium30peptide ergot alkaloidalpha-adrenergic agonist;
mycotoxin;
non-narcotic analgesic;
oxytocic;
serotonergic agonist;
vasoconstrictor agent
chloranil[no description available]medium101,4-benzoquinones;
organochlorine compound		EC 2.7.1.33 (pantothenate kinase) inhibitor;
metabolite
amiben[no description available]medium10chlorobenzoic acid
monuron[no description available]medium103-(3,4-substituted-phenyl)-1,1-dimethylurea;
monochlorobenzenes		environmental contaminant;
herbicide;
xenobiotic
iminodiacetic acid[no description available]medium10amino dicarboxylic acid;
glycine derivative;
non-proteinogenic alpha-amino acid		chelator
phenetidine[no description available]medium10aromatic ether;
primary amino compound;
substituted aniline		drug metabolite
diazooxonorleucine[no description available]medium10amino acid zwitterion;
diazo compound;
ketone;
non-proteinogenic L-alpha-amino acid		analgesic;
antibacterial agent;
antimetabolite;
antineoplastic agent;
antiviral agent;
apoptosis inducer;
bacterial metabolite;
EC 2.4.2.14 (amidophosphoribosyltransferase) inhibitor;
EC 3.5.1.2 (glutaminase) inhibitor;
EC 6.3.4.2 [CTP synthase (glutamine hydrolyzing)] inhibitor;
EC 6.3.5.1 [NAD(+) synthase (glutamine-hydrolysing)] inhibitor;
EC 6.3.5.2 [GMP synthase (glutamine-hydrolysing)] inhibitor;
EC 6.3.5.3 (phosphoribosylformylglycinamidine synthase) inhibitor;
EC 6.3.5.4 [asparagine synthase (glutamine-hydrolysing)] inhibitor;
EC 6.3.5.5 [carbamoyl-phosphate synthase (glutamine-hydrolysing)] inhibitor;
glutamine antagonist
methylpentynol carbamate[no description available]medium10
mechlorethamine n-oxide[no description available]medium10nitrogen mustard
azacitidine[no description available]medium20N-glycosyl-1,3,5-triazine;
nucleoside analogue		antineoplastic agent
linuron[no description available]medium10dichlorobenzene;
phenylureas		agrochemical;
environmental contaminant;
herbicide;
xenobiotic
carbutamide[no description available]medium30benzenes;
sulfonamide
betamethasone[no description available]medium2011beta-hydroxy steroid;
17alpha-hydroxy steroid;
20-oxo steroid;
21-hydroxy steroid;
3-oxo-Delta(1),Delta(4)-steroid;
fluorinated steroid;
glucocorticoid;
primary alpha-hydroxy ketone;
tertiary alpha-hydroxy ketone		anti-asthmatic agent;
anti-inflammatory drug;
immunosuppressive agent
hydantoins[no description available]medium10imidazolidine-2,4-dione
plumbagin[no description available]medium10hydroxy-1,4-naphthoquinone;
phenols		anticoagulant;
antineoplastic agent;
immunological adjuvant;
metabolite
emetine[no description available]medium30isoquinoline alkaloid;
pyridoisoquinoline		antiamoebic agent;
anticoronaviral agent;
antiinfective agent;
antimalarial;
antineoplastic agent;
antiprotozoal drug;
antiviral agent;
autophagy inhibitor;
emetic;
expectorant;
plant metabolite;
protein synthesis inhibitor
pamaquine[no description available]medium10aminoquinoline
mustard gas[no description available]medium10ethyl sulfide;
organochlorine compound		alkylating agent;
carcinogenic agent;
vesicant
hesperidin[no description available]medium203'-hydroxyflavanones;
4'-methoxyflavanones;
dihydroxyflavanone;
disaccharide derivative;
flavanone glycoside;
monomethoxyflavanone;
rutinoside		mutagen
medroxyprogesterone[no description available]medium1017alpha-hydroxy steroid;
20-oxo steroid;
3-oxo-Delta(4) steroid;
tertiary alpha-hydroxy ketone		contraceptive drug;
progestin;
synthetic oral contraceptive
apronalide[no description available]medium10N-acylurea
4,6-dinitro-o-cresol[no description available]medium10dinitrophenol acaricide;
hydroxytoluene;
nitrotoluene		dinitrophenol insecticide;
fungicide;
herbicide
metahexamide[no description available]medium10benzenes;
sulfonamide
megestrol acetate[no description available]medium2020-oxo steroid;
3-oxo-Delta(4) steroid;
acetate ester;
steroid ester		antineoplastic agent;
appetite enhancer;
contraceptive drug;
progestin;
synthetic oral contraceptive
toyocamycin[no description available]medium10antibiotic antifungal agent;
N-glycosylpyrrolopyrimidine;
nitrile;
ribonucleoside		antimetabolite;
antineoplastic agent;
apoptosis inducer;
bacterial metabolite
erythromycin[no description available]medium40cyclic ketone;
erythromycin
hadacidin[no description available]medium10aldehyde;
monocarboxylic acid;
N-hydroxy-alpha-amino-acid		antimicrobial agent;
antineoplastic agent;
Penicillium metabolite;
teratogenic agent
carbophenothion[no description available]medium10organic sulfide
porfiromycin[no description available]medium10
vinblastine[no description available]medium20
deoxyuridine[no description available]medium10pyrimidine 2'-deoxyribonucleosideEscherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
testolactone[no description available]medium103-oxo-Delta(1),Delta(4)-steroid;
seco-androstane
ethambutol[no description available]medium10ethanolamines;
ethylenediamine derivative		antitubercular agent;
environmental contaminant;
xenobiotic
pyrithioxin[no description available]medium10methylpyridines
nsc 65346[no description available]medium10nucleoside analogueprotein kinase inhibitor
guanazole[no description available]medium10aromatic amine;
triazoles		antineoplastic agent;
DNA synthesis inhibitor;
EC 1.17.4.1 (ribonucleoside-diphosphate reductase) inhibitor
meturedepa[no description available]medium10phosphoramide
ioxynil[no description available]medium10iodophenol;
nitrile		environmental contaminant;
herbicide;
xenobiotic
bromoxynil[no description available]medium10dibromobenzene;
hydroxynitrile;
phenols		environmental contaminant;
herbicide;
xenobiotic
picloram[no description available]medium10aminopyridine;
chloropyridine;
organochlorine pesticide;
pyridinemonocarboxylic acid		herbicide;
synthetic auxin
ethoglucid[no description available]medium10epoxide
azaribine[no description available]medium10acetate ester;
N-glycosyl-1,2,4-triazine		antipsoriatic;
prodrug
1,3,5-triglycidyl-s-triazinetrione[no description available]medium10
acetophenazine[no description available]medium10N-(2-hydroxyethyl)piperazine;
N-alkylpiperazine;
phenothiazines		phenothiazine antipsychotic drug
doxifluridine[no description available]medium20organofluorine compound;
pyrimidine 5'-deoxyribonucleoside		antimetabolite;
antineoplastic agent;
prodrug
dicloxacillin[no description available]medium10dichlorobenzene;
penicillin		antibacterial drug
improsan[no description available]medium10organosulfonic ester
streptomycin[no description available]medium50antibiotic antifungal drug;
antibiotic fungicide;
streptomycins		antibacterial drug;
antifungal agrochemical;
antimicrobial agent;
antimicrobial drug;
bacterial metabolite;
protein synthesis inhibitor
piperacetazine[no description available]medium10phenothiazines
beclomethasone[no description available]medium1011beta-hydroxy steroid;
17alpha-hydroxy steroid;
20-oxo steroid;
21-hydroxy steroid;
3-oxo-Delta(1),Delta(4)-steroid;
chlorinated steroid;
corticosteroid;
glucocorticoid;
primary alpha-hydroxy ketone;
tertiary alpha-hydroxy ketone		anti-asthmatic drug;
anti-inflammatory drug
carbenicillin[no description available]medium20penicillin allergen;
penicillin		antibacterial drug
floxacillin[no description available]medium20penicillin allergen;
penicillin		antibacterial drug
pentaquine[no description available]medium10
zalcitabine[no description available]medium20pyrimidine 2',3'-dideoxyribonucleosideantimetabolite;
antiviral drug;
HIV-1 reverse transcriptase inhibitor
isopentenyladenosine[no description available]medium10N-ribosyl-N(6)-isopentenyladenine;
nucleoside analogue		antineoplastic agent;
plant growth regulator;
plant metabolite
ancitabine[no description available]medium10diol;
organic heterotricyclic compound		antimetabolite;
antineoplastic agent;
prodrug
phenacid[no description available]medium10
xipamide[no description available]medium20benzamides
selegiline[no description available]medium20selegiline;
terminal acetylenic compound		geroprotector
cephalexin[no description available]medium10beta-lactam antibiotic allergen;
cephalosporin;
semisynthetic derivative		antibacterial drug
isosorbide-5-mononitrate[no description available]medium30glucitol derivative;
nitrate ester		nitric oxide donor;
vasodilator agent
pentamethylmelamine[no description available]medium10
calusterone[no description available]medium103-hydroxy steroidandrogen
danazol[no description available]medium2017beta-hydroxy steroid;
terminal acetylenic compound		anti-estrogen;
estrogen antagonist;
geroprotector
lisuride[no description available]medium20monocarboxylic acid amideantidyskinesia agent;
antiparkinson drug;
dopamine agonist;
serotonergic agonist
etoprine[no description available]medium10
daunorubicin[no description available]medium20aminoglycoside antibiotic;
anthracycline;
p-quinones;
tetracenequinones		antineoplastic agent;
bacterial metabolite
razoxane[no description available]medium10N-alkylpiperazine
cephapirin[no description available]medium10cephalosporinantibacterial drug
fludarabine phosphate[no description available]medium10nucleoside analogue;
organofluorine compound;
purine arabinonucleoside monophosphate		antimetabolite;
antineoplastic agent;
antiviral agent;
DNA synthesis inhibitor;
immunosuppressive agent;
prodrug
bromocriptine[no description available]medium20indole alkaloidantidyskinesia agent;
antiparkinson drug;
dopamine agonist;
hormone antagonist
triamcinolone[no description available]medium2011beta-hydroxy steroid;
16alpha-hydroxy steroid;
17alpha-hydroxy steroid;
20-oxo steroid;
21-hydroxy steroid;
3-oxo-Delta(4) steroid;
C21-steroid hormone;
fluorinated steroid;
glucocorticoid;
primary alpha-hydroxy ketone;
tertiary alpha-hydroxy ketone		anti-allergic agent;
anti-inflammatory drug
azetepa[no description available]medium10phosphoramide
cefazolin[no description available]medium20beta-lactam antibiotic allergen;
cephalosporin;
tetrazoles;
thiadiazoles		antibacterial drug
ripazepam[no description available]medium10benzenes
amoxicillin[no description available]medium20penicillin allergen;
penicillin		antibacterial drug
timolol[no description available]medium20timololanti-arrhythmia drug;
antiglaucoma drug;
antihypertensive agent;
beta-adrenergic antagonist
prednimustine[no description available]medium10corticosteroid hormone
amygdalin[no description available]medium10cyanogenic glycoside;
disaccharide derivative;
gentiobioside		plant metabolite
amineptin[no description available]medium20amino acid;
carbocyclic fatty acid;
carbotricyclic compound;
secondary amino compound		antidepressant;
dopamine uptake inhibitor
zidovudine[no description available]medium20azide;
pyrimidine 2',3'-dideoxyribonucleoside		antimetabolite;
antiviral drug;
HIV-1 reverse transcriptase inhibitor
tobramycin[no description available]medium20amino cyclitol glycosideantibacterial agent;
antimicrobial agent;
toxin
paclitaxel[no description available]medium20taxane diterpenoid;
tetracyclic diterpenoid		antineoplastic agent;
human metabolite;
metabolite;
microtubule-stabilising agent
etoposide[no description available]medium20beta-D-glucoside;
furonaphthodioxole;
organic heterotetracyclic compound		antineoplastic agent;
DNA synthesis inhibitor
dobutamine[no description available]medium20catecholamine;
secondary amine		beta-adrenergic agonist;
cardiotonic drug;
sympathomimetic agent
ticarcillin[no description available]medium20penicillin allergen;
penicillin		antibacterial drug
etidocaine[no description available]medium10amino acid amidelocal anaesthetic
cephradine[no description available]medium10beta-lactam antibiotic allergen;
cephalosporin		antibacterial drug
methyldopa[no description available]medium30L-tyrosine derivative;
non-proteinogenic L-alpha-amino acid		alpha-adrenergic agonist;
antihypertensive agent;
hapten;
peripheral nervous system drug;
sympatholytic agent
tocainide[no description available]medium10monocarboxylic acid amideanti-arrhythmia drug;
local anaesthetic;
sodium channel blocker
sq-11725[no description available]medium20
nimustine[no description available]medium10aminopyrimidine;
N-nitrosoureas;
organochlorine compound		alkylating agent;
antineoplastic agent
butibufen[no description available]medium10monoterpenoid
spiromustine[no description available]medium10
diaziquone[no description available]medium101,4-benzoquinones;
aziridines;
carbamate ester;
enamine		alkylating agent;
antineoplastic agent
idarubicin[no description available]medium10anthracycline antibiotic;
deoxy hexoside;
monosaccharide derivative
cefonicid[no description available]medium10cephalosporinantibacterial drug
piperacillin[no description available]medium20penicillin allergen;
penicillin		antibacterial drug
triciribine phosphate[no description available]medium10
captopril[no description available]medium30alkanethiol;
L-proline derivative;
N-acylpyrrolidine;
pyrrolidinemonocarboxylic acid		antihypertensive agent;
EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor
bw-755c[no description available]medium10
cefaclor anhydrous[no description available]medium20cephalosporinantibacterial drug;
drug allergen
alfentanil[no description available]medium10monocarboxylic acid amide;
piperidines		central nervous system depressant;
intravenous anaesthetic;
mu-opioid receptor agonist;
opioid analgesic;
peripheral nervous system drug
piritrexim[no description available]medium20
caracemide[no description available]medium10
bambuterol[no description available]medium10carbamate ester;
phenylethanolamines		anti-asthmatic drug;
beta-adrenergic agonist;
bronchodilator agent;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
prodrug;
sympathomimetic agent;
tocolytic agent
quinapril[no description available]medium20dicarboxylic acid monoester;
ethyl ester;
isoquinolines;
tertiary carboxamide		antihypertensive agent;
EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor;
prodrug
cilazapril, anhydrous[no description available]medium10dicarboxylic acid monoester;
ethyl ester;
pyridazinodiazepine		antihypertensive agent;
EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor;
prodrug
2,5-bis(1-aziridinyl)-3,6-bis(2-methoxyethoxy)-4-benzoquinone[no description available]medium101,4-benzoquinones
morzid[no description available]medium10morpholines
febrifugine[no description available]medium10quinazolines
thymine arabinoside[no description available]medium10N-glycosyl compound
psicofuranine[no description available]medium10psicose derivative;
purine nucleoside
triciribine[no description available]medium10nucleoside analogueEC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor
5-chloro-2'-deoxyuridine[no description available]medium10
bendamustine[no description available]medium20benzimidazoles
trofosfamide[no description available]medium10ifosfamides
4-aminobenzoic acid-n-xyloside[no description available]medium10
fotrin[no description available]medium10
sufosfamide[no description available]medium10
propatyl nitrate[no description available]medium10nitrate ester
dexfenfluramine[no description available]medium20fenfluramineappetite depressant;
serotonergic agonist;
serotonin uptake inhibitor
sulfamidochrysoidine[no description available]medium10
ibopamine[no description available]medium10benzoate ester;
phenols
pumitepa[no description available]medium10
elmustine[no description available]medium10
forphenicinol[no description available]medium10
dipropylacetamide[no description available]medium20fatty amidegeroprotector;
metabolite;
teratogenic agent
inproquone[no description available]medium10
neplanocin a[no description available]medium10
1-ethoxysilatrane[no description available]medium10
tretazicar[no description available]medium10
nsc-172755[no description available]medium10
streptovitacin a[no description available]medium10
cb 10375[no description available]medium10
carbenicillin indanyl[no description available]medium10penicillin
cb 1837[no description available]medium10
hexaphosphamide[no description available]medium10
dipin[no description available]medium10
phosphazine[no description available]medium10
diiodobenzotepa[no description available]medium10
icig 1163[no description available]medium10
bimolane[no description available]medium10
thiodipin[no description available]medium10
fluoxydine[no description available]medium10
imiphos[no description available]medium10
aldophosphamide[no description available]medium40nitrogen mustard
perindopril[no description available]medium20alpha-amino acid ester;
dicarboxylic acid monoester;
ethyl ester;
organic heterobicyclic compound		antihypertensive agent;
EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor
3,6-bis(5-chloro-2-piperidyl)-2,5-piperazinedione[no description available]medium10
oxymatrine[no description available]medium10alkaloid;
tertiary amine oxide
1,1,2-trichloroethanol[no description available]medium60
iremycin[no description available]medium10
methotrexate[no description available]medium50dicarboxylic acid;
monocarboxylic acid amide;
pteridines		abortifacient;
antimetabolite;
antineoplastic agent;
antirheumatic drug;
dermatologic drug;
DNA synthesis inhibitor;
EC 1.5.1.3 (dihydrofolate reductase) inhibitor;
immunosuppressive agent
n,n'-bis((2-chloroethyl)nitrosocarbamoyl)cystamine[no description available]medium10
hainanensine[no description available]medium10
ritrosulfan[no description available]medium10
damvar[no description available]medium10
benzo-tepa[no description available]medium10
tevenel[no description available]medium10sulfonamide
tac 278[no description available]medium10
aminopterin[no description available]medium20dicarboxylic acidEC 1.5.1.3 (dihydrofolate reductase) inhibitor;
mutagen
(4r)-3-((2s)-3-mercapto-2-methylpropanoyl)-4- thiazolidinecarboxylic acid[no description available]medium10
atropine[no description available]medium300
atropine[no description available]medium303
deflazacort[no description available]medium10corticosteroid hormone
hexestrol diphosphate[no description available]medium10
carbocysteine[no description available]medium10L-cysteine thioether;
non-proteinogenic L-alpha-amino acid		mucolytic
demecolcine[no description available]medium20alkaloid;
secondary amino compound		antineoplastic agent;
microtubule-destabilising agent
nsc-89199[no description available]medium10carbamate ester;
organochlorine compound;
steroid phosphate
estramustine[no description available]medium2017beta-hydroxy steroid;
carbamate ester;
organochlorine compound		alkylating agent;
antineoplastic agent;
radiation protective agent
phenethicillin[no description available]medium10penicillin allergen;
penicillin
indicine-n-oxide[no description available]medium10
trimethoprim, sulfamethoxazole drug combination[no description available]medium10
oxytocin[no description available]medium20heterodetic cyclic peptide;
peptide hormone		oxytocic;
vasodilator agent
pentostatin[no description available]medium10coformycinsantimetabolite;
antineoplastic agent;
Aspergillus metabolite;
bacterial metabolite;
EC 3.5.4.4 (adenosine deaminase) inhibitor
cefoxitin[no description available]medium10beta-lactam antibiotic allergen;
cephalosporin;
cephamycin;
semisynthetic derivative		antibacterial drug
digitoxin[no description available]medium40cardenolide glycosideEC 3.6.3.9 (Na(+)/K(+)-transporting ATPase) inhibitor
netilmicin[no description available]medium20
bacampicillin[no description available]medium10penicillanic acid esterprodrug
angustibalin[no description available]medium10sesquiterpene lactone
metrizamide[no description available]medium10amino sugar
retinol[no description available]medium20retinol;
vitamin A		human metabolite;
mouse metabolite;
plant metabolite
mycophenolic acid[no description available]medium202-benzofurans;
gamma-lactone;
monocarboxylic acid;
phenols		anticoronaviral agent;
antimicrobial agent;
antineoplastic agent;
EC 1.1.1.205 (IMP dehydrogenase) inhibitor;
environmental contaminant;
immunosuppressive agent;
mycotoxin;
Penicillium metabolite;
xenobiotic
clindamycin[no description available]medium20
fosfomycin[no description available]medium20epoxide;
phosphonic acids		antimicrobial agent;
EC 2.5.1.7 (UDP-N-acetylglucosamine 1-carboxyvinyltransferase) inhibitor
formycin[no description available]medium10formycinantineoplastic agent
teniposide[no description available]medium20aromatic ether;
beta-D-glucoside;
cyclic acetal;
furonaphthodioxole;
gamma-lactone;
monosaccharide derivative;
phenols;
thiophenes		antineoplastic agent;
EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor
cefamandole[no description available]medium10cephalosporin;
semisynthetic derivative		antibacterial drug
tiazofurin[no description available]medium201,3-thiazoles;
C-glycosyl compound;
monocarboxylic acid amide		antineoplastic agent;
EC 1.1.1.205 (IMP dehydrogenase) inhibitor;
prodrug
azaserine[no description available]medium20carboxylic ester;
diazo compound;
L-serine derivative;
non-proteinogenic L-alpha-amino acid		antifungal agent;
antimetabolite;
antimicrobial agent;
antineoplastic agent;
glutamine antagonist;
immunosuppressive agent;
metabolite
melphalan[no description available]medium20L-phenylalanine derivative;
nitrogen mustard;
non-proteinogenic L-alpha-amino acid;
organochlorine compound		alkylating agent;
antineoplastic agent;
carcinogenic agent;
drug allergen;
immunosuppressive agent
dipyrone[no description available]medium40organic sodium saltanti-inflammatory agent;
antipyretic;
antirheumatic drug;
cyclooxygenase 3 inhibitor;
non-narcotic analgesic;
peripheral nervous system drug;
prodrug
4-[[bis(2-hydroxyethyl)amino]methyl]-2,6-ditert-butylphenol[no description available]medium10alkylbenzene
aceglatone[no description available]medium10organic molecular entity
carbenoxolone[no description available]medium20
amygdalin[no description available]medium10amygdalinantineoplastic agent;
apoptosis inducer;
plant metabolite
mitobronitol[no description available]medium10alcohol;
organobromine compound
leuprolide[no description available]medium10oligopeptideanti-estrogen;
antineoplastic agent;
gonadotropin releasing hormone agonist
octotropine methylbromide[no description available]medium10
fludarabine[no description available]medium10purine nucleoside
propylthiouracil[no description available]medium20pyrimidinethioneantidote to paracetamol poisoning;
antimetabolite;
antioxidant;
antithyroid drug;
carcinogenic agent;
EC 1.14.13.39 (nitric oxide synthase) inhibitor;
hormone antagonist
methylatropine nitrate[no description available]medium10
mercaptopurine[no description available]medium20aryl thiol;
purines;
thiocarbonyl compound		anticoronaviral agent;
antimetabolite;
antineoplastic agent
thioinosine[no description available]medium10
thiouracil[no description available]medium20nucleobase analogue;
thiocarbonyl compound		antithyroid drug;
metabolite
methimazole[no description available]medium201,3-dihydroimidazole-2-thionesantithyroid drug
thioguanine anhydrous[no description available]medium202-aminopurinesanticoronaviral agent;
antimetabolite;
antineoplastic agent
digoxin[no description available]medium70cardenolide glycoside;
steroid saponin		anti-arrhythmia drug;
cardiotonic drug;
EC 3.6.3.9 (Na(+)/K(+)-transporting ATPase) inhibitor;
epitope
6-thioguanosine[no description available]medium10purine nucleoside
streptozocin[no description available]medium20
ethionamide[no description available]medium20pyridines;
thiocarboxamide		antilipemic drug;
antitubercular agent;
fatty acid synthesis inhibitor;
leprostatic drug;
prodrug
lincomycin[no description available]medium10carbohydrate-containing antibiotic;
L-proline derivative;
monocarboxylic acid amide;
pyrrolidinecarboxamide;
S-glycosyl compound		antimicrobial agent;
bacterial metabolite
thiocarlide[no description available]medium10thioureas
mannomustine[no description available]medium10amino alcohol
gestodene[no description available]medium20steroidestrogen
glucametacin[no description available]medium10
1-(2-(2-(4-pyridyl)-2-imidazoline-1-yl)ethyl)-3-(4-carboxyphenyl)urea[no description available]medium10
hymecromone[no description available]medium10hydroxycoumarinantineoplastic agent;
hyaluronic acid synthesis inhibitor
alprostadil[no description available]medium20prostaglandins Eanticoagulant;
human metabolite;
platelet aggregation inhibitor;
vasodilator agent
amphotericin b[no description available]medium30antibiotic antifungal drug;
macrolide antibiotic;
polyene antibiotic		antiamoebic agent;
antiprotozoal drug;
bacterial metabolite
cynarine[no description available]medium20alkyl caffeate ester;
quinic acid		plant metabolite
7432 s[no description available]medium10cephalosporin;
dicarboxylic acid		antibacterial drug
codeine[no description available]high30morphinane alkaloid;
organic heteropentacyclic compound		antitussive;
drug allergen;
environmental contaminant;
opioid analgesic;
opioid receptor agonist;
prodrug;
xenobiotic
cyclosporine[no description available]medium20homodetic cyclic peptideanti-asthmatic drug;
anticoronaviral agent;
antifungal agent;
antirheumatic drug;
carcinogenic agent;
dermatologic drug;
EC 3.1.3.16 (phosphoprotein phosphatase) inhibitor;
geroprotector;
immunosuppressive agent;
metabolite
dihydrocodeine[no description available]medium10morphinane alkaloid
ly 163892[no description available]medium10carbacephem;
zwitterion		antibacterial drug;
antimicrobial agent
naloxone[no description available]medium90morphinane alkaloid;
organic heteropentacyclic compound;
tertiary alcohol		antidote to opioid poisoning;
central nervous system depressant;
mu-opioid receptor antagonist
morphine[no description available]high471morphinane alkaloid;
organic heteropentacyclic compound;
tertiary amino compound		anaesthetic;
drug allergen;
environmental contaminant;
geroprotector;
mu-opioid receptor agonist;
opioid analgesic;
plant metabolite;
vasodilator agent;
xenobiotic
morphine[no description available]high470morphinane alkaloid;
organic heteropentacyclic compound;
tertiary amino compound		anaesthetic;
drug allergen;
environmental contaminant;
geroprotector;
mu-opioid receptor agonist;
opioid analgesic;
plant metabolite;
vasodilator agent;
xenobiotic
pactamycin[no description available]medium10
anthramycin[no description available]medium10
lacidipine[no description available]medium10cinnamate ester;
tert-butyl ester
cytochalasin b[no description available]medium30cytochalasin;
lactam;
lactone;
organic heterotricyclic compound		actin polymerisation inhibitor;
metabolite;
mycotoxin;
platelet aggregation inhibitor
vinorelbine[no description available]medium20acetate ester;
methyl ester;
organic heteropentacyclic compound;
organic heterotetracyclic compound;
ring assembly;
vinca alkaloid		antineoplastic agent;
photosensitizing agent
irisquinone[no description available]medium10
mitoguazone[no description available]medium10guanidines;
hydrazone		antineoplastic agent;
apoptosis inducer;
EC 4.1.1.50 (adenosylmethionine decarboxylase) inhibitor
cefixime[no description available]medium20cephalosporinantibacterial drug;
drug allergen
ramipril[no description available]medium20azabicycloalkane;
cyclopentapyrrole;
dicarboxylic acid monoester;
dipeptide;
ethyl ester		bradykinin receptor B2 agonist;
cardioprotective agent;
EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor;
matrix metalloproteinase inhibitor;
prodrug
enalapril[no description available]medium20dicarboxylic acid monoester;
dipeptide		antihypertensive agent;
EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor;
geroprotector;
prodrug
nitrofurazone[no description available]medium20
cefuroxime[no description available]medium103-(carbamoyloxymethyl)cephalosporin;
furans;
oxime O-ether		drug allergen
ceftriaxone[no description available]medium201,2,4-triazines;
1,3-thiazoles;
cephalosporin;
oxime O-ether		antibacterial drug;
drug allergen;
EC 3.5.2.6 (beta-lactamase) inhibitor
ceftazidime[no description available]medium10cephalosporin;
oxime O-ether		antibacterial drug;
drug allergen;
EC 2.4.1.129 (peptidoglycan glycosyltransferase) inhibitor
ceftiofur[no description available]medium10
cilastatin[no description available]medium10carboxamide;
L-cysteine derivative;
non-proteinogenic L-alpha-amino acid;
organic sulfide		EC 3.4.13.19 (membrane dipeptidase) inhibitor;
environmental contaminant;
protease inhibitor;
xenobiotic
sibiromycin[no description available]medium10aminoglycoside antibiotic;
hemiaminal;
phenols;
pyrrolobenzodiazepine		antineoplastic agent;
bacterial metabolite
ceftizoxime[no description available]medium10cephalosporinantibacterial drug
1-methyl-d-lysergic acid butanolamide[no description available]medium10ergot alkaloid;
monocarboxylic acid amide		serotonergic antagonist;
sympatholytic agent;
vasoconstrictor agent
nitrofurantoin[no description available]medium20imidazolidine-2,4-dione;
nitrofuran antibiotic;
organonitrogen heterocyclic antibiotic;
organooxygen heterocyclic antibiotic		antibacterial drug;
antiinfective agent;
hepatotoxic agent
butylscopolammonium bromide[no description available]medium10
fumagillin[no description available]medium10antibiotic antifungal drug;
carboxylic ester;
dicarboxylic acid monoester;
meroterpenoid;
organooxygen heterocyclic antibiotic;
spiro-epoxide		angiogenesis inhibitor;
antibacterial drug;
antimicrobial agent;
antiprotozoal drug;
fungal metabolite;
methionine aminopeptidase 2 inhibitor
thioacetazone[no description available]medium10
treosulfan[no description available]medium10methanesulfonate ester
gentamicin sulfate[no description available]medium20
nkp 608[no description available]medium10
ganu[no description available]medium10
metamelfalan[no description available]medium10
vindesine[no description available]medium10
diflucortolone[no description available]medium1021-hydroxy steroid
2-((3-chloroethyl)-3-nitrosoureido)glucopyranose[no description available]medium10
ro 6-4563[no description available]medium10monoterpenoid
flucloronide[no description available]medium1021-hydroxy steroid
hainanolide[no description available]medium10
gliocladic acid[no description available]medium10p-menthane monoterpenoid
cleistanthin[no description available]medium10cleistanthins;
xylose derivative		alpha-adrenergic antagonist;
antihypertensive agent;
diuretic
nimorazole[no description available]medium10
ascorbic acid[no description available]medium90ascorbic acid;
vitamin C		coenzyme;
cofactor;
flour treatment agent;
food antioxidant;
food colour retention agent;
geroprotector;
plant metabolite;
skin lightening agent
novobiocin[no description available]medium30carbamate ester;
ether;
hexoside;
hydroxycoumarin;
monocarboxylic acid amide;
monosaccharide derivative;
phenols		antibacterial agent;
antimicrobial agent;
EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor;
Escherichia coli metabolite;
hepatoprotective agent
tetracycline[no description available]medium50
chlortetracycline[no description available]medium30
oxytetracycline, anhydrous[no description available]medium50
minocycline[no description available]medium20
bactobolin[no description available]medium10amino acid amide
mobiflex[no description available]medium20heteroaryl hydroxy compound;
monocarboxylic acid amide;
pyridines;
thienothiazine		antipyretic;
EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug
demeclocycline[no description available]medium10
acyclovir[no description available]medium302-aminopurines;
oxopurine		antimetabolite;
antiviral drug
rifampin[no description available]medium20cyclic ketal;
hydrazone;
N-iminopiperazine;
N-methylpiperazine;
rifamycins;
semisynthetic derivative;
zwitterion		angiogenesis inhibitor;
antiamoebic agent;
antineoplastic agent;
antitubercular agent;
DNA synthesis inhibitor;
EC 2.7.7.6 (RNA polymerase) inhibitor;
Escherichia coli metabolite;
geroprotector;
leprostatic drug;
neuroprotective agent;
pregnane X receptor agonist;
protein synthesis inhibitor
dacarbazine[no description available]medium20dacarbazine
ganciclovir[no description available]medium202-aminopurines;
oxopurine		antiinfective agent;
antiviral drug
allopurinol[no description available]medium50nucleobase analogue;
organic heterobicyclic compound		antimetabolite;
EC 1.17.3.2 (xanthine oxidase) inhibitor;
gout suppressant;
radical scavenger
azaguanine[no description available]medium20nucleobase analogue;
triazolopyrimidines		antimetabolite;
antineoplastic agent;
EC 2.4.2.1 (purine-nucleoside phosphorylase) inhibitor
alanosine[no description available]medium20
7-deazaguanosine[no description available]medium10
pyrazofurin[no description available]medium10C-glycosyl compound;
pyrazoles		antimetabolite;
antimicrobial agent;
antineoplastic agent;
EC 4.1.1.23 (orotidine-5'-phosphate decarboxylase) inhibitor
n(10)-methylfolate[no description available]medium10folic acids
5-methyltetrahydrohomofolic acid[no description available]medium10
ninopterin[no description available]medium10
acetic acid[no description available]medium40monocarboxylic acidantimicrobial food preservative;
Daphnia magna metabolite;
food acidity regulator;
protic solvent
acetamide[no description available]medium10acetamides;
carboximidic acid;
monocarboxylic acid amide;
N-acylammonia
adenine[no description available]high206-aminopurines;
purine nucleobase		Daphnia magna metabolite;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
allantoin[no description available]medium10imidazolidine-2,4-dione;
ureas		Escherichia coli metabolite;
human metabolite;
Saccharomyces cerevisiae metabolite;
vulnerary
betaine[no description available]medium80amino-acid betaine;
glycine derivative		fundamental metabolite
carnitine[no description available]medium10amino-acid betainehuman metabolite;
mouse metabolite
citric acid, anhydrous[no description available]medium10tricarboxylic acidantimicrobial agent;
chelator;
food acidity regulator;
fundamental metabolite
salicylic acid[no description available]medium20monohydroxybenzoic acidalgal metabolite;
antifungal agent;
antiinfective agent;
EC 1.11.1.11 (L-ascorbate peroxidase) inhibitor;
keratolytic drug;
plant hormone;
plant metabolite
bupropion[no description available]medium10aromatic ketone;
monochlorobenzenes;
secondary amino compound		antidepressant;
environmental contaminant;
xenobiotic
creatine[no description available]high30glycine derivative;
guanidines;
zwitterion		geroprotector;
human metabolite;
mouse metabolite;
neuroprotective agent;
nutraceutical
lactic acid[no description available]medium802-hydroxy monocarboxylic acidalgal metabolite;
Daphnia magna metabolite
dimethyl sulfoxide[no description available]medium20sulfoxide;
volatile organic compound		alkylating agent;
antidote;
Escherichia coli metabolite;
geroprotector;
MRI contrast agent;
non-narcotic analgesic;
polar aprotic solvent;
radical scavenger
formaldehyde[no description available]high160aldehyde;
one-carbon compound		allergen;
carcinogenic agent;
disinfectant;
EC 3.5.1.4 (amidase) inhibitor;
environmental contaminant;
Escherichia coli metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
glycine[no description available]medium60alpha-amino acid;
amino acid zwitterion;
proteinogenic amino acid;
serine family amino acid		EC 2.1.2.1 (glycine hydroxymethyltransferase) inhibitor;
fundamental metabolite;
hepatoprotective agent;
micronutrient;
neurotransmitter;
NMDA receptor agonist;
nutraceutical
glycerol[no description available]high80alditol;
triol		algal metabolite;
detergent;
Escherichia coli metabolite;
geroprotector;
human metabolite;
mouse metabolite;
osmolyte;
Saccharomyces cerevisiae metabolite;
solvent
hydroquinone[no description available]medium210benzenediol;
hydroquinones		antioxidant;
carcinogenic agent;
cofactor;
Escherichia coli metabolite;
human xenobiotic metabolite;
mouse metabolite;
skin lightening agent
inositol[no description available]medium10cyclitol;
hexol
niacinamide[no description available]high40pyridine alkaloid;
pyridinecarboxamide;
vitamin B3		anti-inflammatory agent;
antioxidant;
cofactor;
EC 2.4.2.30 (NAD(+) ADP-ribosyltransferase) inhibitor;
EC 3.5.1.98 (histone deacetylase) inhibitor;
Escherichia coli metabolite;
geroprotector;
human urinary metabolite;
metabolite;
mouse metabolite;
neuroprotective agent;
Saccharomyces cerevisiae metabolite;
Sir2 inhibitor
niacin[no description available]medium10pyridine alkaloid;
pyridinemonocarboxylic acid;
vitamin B3		antidote;
antilipemic drug;
EC 3.5.1.19 (nicotinamidase) inhibitor;
Escherichia coli metabolite;
human urinary metabolite;
metabolite;
mouse metabolite;
plant metabolite;
vasodilator agent
orotic acid[no description available]high20pyrimidinemonocarboxylic acidEscherichia coli metabolite;
metabolite;
mouse metabolite
4-aminobenzoic acid[no description available]medium10aminobenzoic acid;
aromatic amino-acid zwitterion		allergen;
Escherichia coli metabolite;
plant metabolite
phenol[no description available]high20phenolsantiseptic drug;
disinfectant;
human xenobiotic metabolite;
mouse metabolite
phenylacetic acid[no description available]medium10benzenes;
monocarboxylic acid;
phenylacetic acids		allergen;
Aspergillus metabolite;
auxin;
EC 6.4.1.1 (pyruvate carboxylase) inhibitor;
Escherichia coli metabolite;
human metabolite;
plant growth retardant;
plant metabolite;
Saccharomyces cerevisiae metabolite;
toxin
pyridoxal phosphate[no description available]medium10methylpyridines;
monohydroxypyridine;
pyridinecarbaldehyde;
vitamin B6 phosphate		coenzyme;
cofactor;
EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
pyridoxine[no description available]medium10hydroxymethylpyridine;
methylpyridines;
monohydroxypyridine;
vitamin B6		cofactor;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
thiamine[no description available]high20primary alcohol;
vitamin B1		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
uracil[no description available]medium10pyrimidine nucleobase;
pyrimidone		allergen;
Daphnia magna metabolite;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
prodrug;
Saccharomyces cerevisiae metabolite
urea[no description available]high220isourea;
monocarboxylic acid amide;
one-carbon compound		Daphnia magna metabolite;
Escherichia coli metabolite;
fertilizer;
flour treatment agent;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
catechin[no description available]medium10hydroxyflavan
menthol[no description available]medium10p-menthane monoterpenoid;
secondary alcohol		volatile oil component
acetohydroxamic acid[no description available]medium10acetohydroxamic acids;
carbohydroximic acid		algal metabolite;
EC 3.5.1.5 (urease) inhibitor
albendazole[no description available]medium10aryl sulfide;
benzimidazoles;
benzimidazolylcarbamate fungicide;
carbamate ester		anthelminthic drug;
microtubule-destabilising agent;
tubulin modulator
alfuzosin[no description available]medium10monocarboxylic acid amide;
quinazolines;
tetrahydrofuranol		alpha-adrenergic antagonist;
antihypertensive agent;
antineoplastic agent
ambroxol[no description available]medium10aromatic amine
pimagedine[no description available]medium10guanidines;
one-carbon compound		EC 1.14.13.39 (nitric oxide synthase) inhibitor;
EC 1.4.3.4 (monoamine oxidase) inhibitor
amiodarone[no description available]medium101-benzofurans;
aromatic ketone;
organoiodine compound;
tertiary amino compound		cardiovascular drug
amitriptyline[no description available]high53carbotricyclic compound;
tertiary amine		adrenergic uptake inhibitor;
antidepressant;
environmental contaminant;
tropomyosin-related kinase B receptor agonist;
xenobiotic
amitriptyline[no description available]high50carbotricyclic compound;
tertiary amine		adrenergic uptake inhibitor;
antidepressant;
environmental contaminant;
tropomyosin-related kinase B receptor agonist;
xenobiotic
amobarbital[no description available]medium390barbiturates
amobarbital[no description available]medium393barbiturates
amsacrine[no description available]medium10acridines;
aromatic ether;
sulfonamide		antineoplastic agent;
EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor
anastrozole[no description available]medium10nitrile;
triazoles		antineoplastic agent;
EC 1.14.14.14 (aromatase) inhibitor
anethole trithione[no description available]medium10methoxybenzenes
anthralin[no description available]medium10anthracenesantipsoriatic
baclofen[no description available]medium40amino acid zwitterion;
gamma-amino acid;
monocarboxylic acid;
monochlorobenzenes;
primary amino compound		central nervous system depressant;
GABA agonist;
muscle relaxant
barbital[no description available]medium90barbituratesdrug allergen
bendazac[no description available]medium10indazoles;
monocarboxylic acid		non-steroidal anti-inflammatory drug;
radical scavenger
benzbromarone[no description available]medium101-benzofurans;
aromatic ketone		uricosuric drug
bicalutamide[no description available]medium10(trifluoromethyl)benzenes;
monocarboxylic acid amide;
monofluorobenzenes;
nitrile;
sulfone;
tertiary alcohol
bay h 4502[no description available]medium10biphenyls;
imidazoles
bromisovalum[no description available]medium20N-acylurea;
organobromine compound
brotizolam[no description available]medium10organic molecular entity
buspirone[no description available]medium10azaspiro compound;
N-alkylpiperazine;
N-arylpiperazine;
organic heteropolycyclic compound;
piperidones;
pyrimidines		anxiolytic drug;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
sedative;
serotonergic agonist
butalbital[no description available]medium10barbituratesanalgesic;
sedative
verapamil[no description available]medium40aromatic ether;
nitrile;
polyether;
tertiary amino compound
candesartan cilexetil[no description available]medium10biphenyls
carbamazepine[no description available]high40dibenzoazepine;
ureas		analgesic;
anticonvulsant;
antimanic drug;
drug allergen;
EC 3.5.1.98 (histone deacetylase) inhibitor;
environmental contaminant;
glutamate transporter activator;
mitogen;
non-narcotic analgesic;
sodium channel blocker;
xenobiotic
carisoprodol[no description available]medium30carbamate estermuscle relaxant
carprofen[no description available]medium10carbazoles;
organochlorine compound		EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
non-steroidal anti-inflammatory drug;
photosensitizing agent
carvedilol[no description available]medium10carbazoles;
secondary alcohol;
secondary amino compound		alpha-adrenergic antagonist;
antihypertensive agent;
beta-adrenergic antagonist;
cardiovascular drug;
vasodilator agent
celecoxib[no description available]medium10organofluorine compound;
pyrazoles;
sulfonamide;
toluenes		cyclooxygenase 2 inhibitor;
geroprotector;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug
cetirizine[no description available]medium10ether;
monocarboxylic acid;
monochlorobenzenes;
piperazines		anti-allergic agent;
environmental contaminant;
H1-receptor antagonist;
xenobiotic
chlordiazepoxide[no description available]medium330benzodiazepine
chlordiazepoxide[no description available]medium336benzodiazepine
chlormezanone[no description available]medium101,3-thiazine;
lactam;
monochlorobenzenes;
sulfone		antipsychotic agent;
anxiolytic drug;
muscle relaxant
chloroxylenol[no description available]medium10monochlorobenzenes;
phenols		antiseptic drug;
disinfectant;
molluscicide
chlorpheniramine[no description available]medium20monochlorobenzenes;
pyridines;
tertiary amino compound		anti-allergic agent;
antidepressant;
antipruritic drug;
H1-receptor antagonist;
histamine antagonist;
serotonin uptake inhibitor
chlorpromazine[no description available]high805organochlorine compound;
phenothiazines;
tertiary amine		anticoronaviral agent;
antiemetic;
dopaminergic antagonist;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
phenothiazine antipsychotic drug
chlorpromazine[no description available]high800organochlorine compound;
phenothiazines;
tertiary amine		anticoronaviral agent;
antiemetic;
dopaminergic antagonist;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
phenothiazine antipsychotic drug
chlorzoxazone[no description available]high201,3-benzoxazoles;
heteroaryl hydroxy compound;
organochlorine compound		muscle relaxant;
sedative
cinoxacin[no description available]medium10cinnolines;
oxacycle;
oxo carboxylic acid		antibacterial drug;
antiinfective agent
ciprofibrate[no description available]medium10cyclopropanes;
monocarboxylic acid;
organochlorine compound		antilipemic drug
ciprofloxacin[no description available]medium10aminoquinoline;
cyclopropanes;
fluoroquinolone antibiotic;
N-arylpiperazine;
quinolinemonocarboxylic acid;
quinolone antibiotic;
quinolone;
zwitterion		antibacterial drug;
antiinfective agent;
antimicrobial agent;
DNA synthesis inhibitor;
EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor;
environmental contaminant;
topoisomerase IV inhibitor;
xenobiotic
cisapride[no description available]medium10benzamides
citalopram[no description available]medium102-benzofurans;
cyclic ether;
nitrile;
organofluorine compound;
tertiary amino compound
clobazam[no description available]medium101,4-benzodiazepinone;
organochlorine compound		anticonvulsant;
anxiolytic drug;
GABA modulator
clofazimine[no description available]medium10monochlorobenzenes;
phenazines		dye;
leprostatic drug;
non-steroidal anti-inflammatory drug
clofibrate[no description available]medium30aromatic ether;
ethyl ester;
monochlorobenzenes		anticholesteremic drug;
antilipemic drug;
geroprotector;
PPARalpha agonist
clomiphene[no description available]medium10tertiary amineestrogen antagonist;
estrogen receptor modulator
clonidine[no description available]medium90clonidine;
imidazoline
clotiazepam[no description available]medium10organic molecular entity
clotrimazole[no description available]medium10conazole antifungal drug;
imidazole antifungal drug;
imidazoles;
monochlorobenzenes		antiinfective agent;
environmental contaminant;
xenobiotic
cyclandelate[no description available]medium10carboxylic ester;
secondary alcohol		vasodilator agent
cyproheptadine[no description available]medium10piperidines;
tertiary amine		anti-allergic agent;
antipruritic drug;
gastrointestinal drug;
H1-receptor antagonist;
serotonergic antagonist
danthron[no description available]medium10dihydroxyanthraquinoneapoptosis inducer;
plant metabolite
deferoxamine[no description available]medium10acyclic desferrioxaminebacterial metabolite;
ferroptosis inhibitor;
iron chelator;
siderophore
amphetamine[no description available]medium440primary amine
eflornithine[no description available]medium10alpha-amino acid;
fluoroamino acid		trypanocidal drug
diazepam[no description available]high9561,4-benzodiazepinone;
organochlorine compound		anticonvulsant;
anxiolytic drug;
environmental contaminant;
sedative;
xenobiotic
diazepam[no description available]high9501,4-benzodiazepinone;
organochlorine compound		anticonvulsant;
anxiolytic drug;
environmental contaminant;
sedative;
xenobiotic
diclofenac[no description available]medium10amino acid;
aromatic amine;
dichlorobenzene;
monocarboxylic acid;
secondary amino compound		antipyretic;
drug allergen;
EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
environmental contaminant;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
xenobiotic
ddt[no description available]medium30benzenoid aromatic compound;
chlorophenylethane;
monochlorobenzenes;
organochlorine insecticide		bridged diphenyl acaricide;
carcinogenic agent;
endocrine disruptor;
persistent organic pollutant
diphenhydramine[no description available]high244ether;
tertiary amino compound		anti-allergic agent;
antidyskinesia agent;
antiemetic;
antiparkinson drug;
antipruritic drug;
antitussive;
H1-receptor antagonist;
local anaesthetic;
muscarinic antagonist;
oneirogen;
sedative
diphenhydramine[no description available]high240ether;
tertiary amino compound		anti-allergic agent;
antidyskinesia agent;
antiemetic;
antiparkinson drug;
antipruritic drug;
antitussive;
H1-receptor antagonist;
local anaesthetic;
muscarinic antagonist;
oneirogen;
sedative
doxepin[no description available]medium10dibenzooxepine;
tertiary amino compound		antidepressant
droperidol[no description available]medium80aromatic ketone;
benzimidazoles;
organofluorine compound		anaesthesia adjuvant;
antiemetic;
dopaminergic antagonist;
first generation antipsychotic
droperidol[no description available]medium82aromatic ketone;
benzimidazoles;
organofluorine compound		anaesthesia adjuvant;
antiemetic;
dopaminergic antagonist;
first generation antipsychotic
econazole[no description available]medium190dichlorobenzene;
ether;
imidazoles;
monochlorobenzenes
enflurane[no description available]high40ether;
organochlorine compound;
organofluorine compound		anaesthetic
enoxacin[no description available]medium101,8-naphthyridine derivative;
amino acid;
fluoroquinolone antibiotic;
monocarboxylic acid;
N-arylpiperazine;
quinolone antibiotic		antibacterial drug;
DNA synthesis inhibitor
estazolam[no description available]medium10triazoles;
triazolobenzodiazepine		anticonvulsant;
anxiolytic drug;
GABA modulator
ethacrynic acid[no description available]medium30aromatic ether;
aromatic ketone;
dichlorobenzene;
monocarboxylic acid		EC 2.5.1.18 (glutathione transferase) inhibitor;
ion transport inhibitor;
loop diuretic
ethoxzolamide[no description available]medium10aromatic ether;
benzothiazoles;
sulfonamide		antiglaucoma drug;
diuretic;
EC 4.2.1.1 (carbonic anhydrase) inhibitor
etodolac[no description available]medium10monocarboxylic acid;
organic heterotricyclic compound		antipyretic;
cyclooxygenase 2 inhibitor;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug
brl 42810[no description available]medium102-aminopurines;
acetate ester		antiviral drug;
prodrug
felbamate[no description available]medium10carbamate esteranticonvulsant;
neuroprotective agent
fenofibrate[no description available]medium10aromatic ether;
chlorobenzophenone;
isopropyl ester;
monochlorobenzenes		antilipemic drug;
environmental contaminant;
geroprotector;
xenobiotic
fentanyl[no description available]medium180anilide;
monocarboxylic acid amide;
piperidines		adjuvant;
anaesthesia adjuvant;
anaesthetic;
intravenous anaesthetic;
mu-opioid receptor agonist;
opioid analgesic
fluconazole[no description available]medium10conazole antifungal drug;
difluorobenzene;
tertiary alcohol;
triazole antifungal drug		environmental contaminant;
P450 inhibitor;
xenobiotic
flufenamic acid[no description available]medium20aromatic amino acid;
organofluorine compound		antipyretic;
EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug
flumazenil[no description available]medium30ethyl ester;
imidazobenzodiazepine;
organofluorine compound		antidote to benzodiazepine poisoning;
GABA antagonist
flunitrazepam[no description available]high411,4-benzodiazepinone;
C-nitro compound;
monofluorobenzenes		anxiolytic drug;
GABAA receptor agonist;
sedative
flunitrazepam[no description available]high401,4-benzodiazepinone;
C-nitro compound;
monofluorobenzenes		anxiolytic drug;
GABAA receptor agonist;
sedative
fluoxetine[no description available]medium20(trifluoromethyl)benzenes;
aromatic ether;
secondary amino compound
flurbiprofen[no description available]medium10fluorobiphenyl;
monocarboxylic acid		antipyretic;
EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug
fomepizole[no description available]medium10pyrazolesantidote;
EC 1.1.1.1 (alcohol dehydrogenase) inhibitor;
protective agent
glafenine[no description available]medium10aminoquinoline;
carboxylic ester;
glycol;
organochlorine compound;
secondary amino compound		inhibitor;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug
gliclazide[no description available]medium10N-sulfonylureahypoglycemic agent;
insulin secretagogue;
radical scavenger
gossypol[no description available]medium10
guaiazulene[no description available]medium10sesquiterpene
fasudil[no description available]medium10isoquinolines;
N-sulfonyldiazepane		antihypertensive agent;
calcium channel blocker;
EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor;
geroprotector;
neuroprotective agent;
nootropic agent;
vasodilator agent
haloperidol[no description available]medium280aromatic ketone;
hydroxypiperidine;
monochlorobenzenes;
organofluorine compound;
tertiary alcohol		antidyskinesia agent;
antiemetic;
dopaminergic antagonist;
first generation antipsychotic;
serotonergic antagonist
hexachlorophene[no description available]medium10bridged diphenyl fungicide;
polyphenol;
trichlorobenzene		acaricide;
antibacterial agent;
antifungal agrochemical;
antiseptic drug
miltefosine[no description available]medium10phosphocholines;
phospholipid		anti-inflammatory agent;
anticoronaviral agent;
antifungal agent;
antineoplastic agent;
antiprotozoal drug;
apoptosis inducer;
immunomodulator;
protein kinase inhibitor
hexestrol[no description available]medium10stilbenoid
hexetidine[no description available]medium10organic heteromonocyclic compound;
organonitrogen heterocyclic compound
hexobarbital[no description available]medium620barbiturates
hydroxyzine[no description available]medium750hydroxyether;
monochlorobenzenes;
N-alkylpiperazine		anticoronaviral agent;
antipruritic drug;
anxiolytic drug;
dermatologic drug;
H1-receptor antagonist
hydroxyzine[no description available]medium759hydroxyether;
monochlorobenzenes;
N-alkylpiperazine		anticoronaviral agent;
antipruritic drug;
anxiolytic drug;
dermatologic drug;
H1-receptor antagonist
alverine[no description available]medium10tertiary amineantispasmodic drug
idebenone[no description available]medium101,4-benzoquinones;
primary alcohol		antioxidant;
ferroptosis inhibitor
ifosfamide[no description available]medium10ifosfamidesalkylating agent;
antineoplastic agent;
environmental contaminant;
immunosuppressive agent;
xenobiotic
imipramine[no description available]medium150dibenzoazepineadrenergic uptake inhibitor;
antidepressant;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor
imipramine[no description available]medium151dibenzoazepineadrenergic uptake inhibitor;
antidepressant;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor
indomethacin[no description available]high30aromatic ether;
indole-3-acetic acids;
monochlorobenzenes;
N-acylindole		analgesic;
drug metabolite;
EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
environmental contaminant;
gout suppressant;
non-steroidal anti-inflammatory drug;
xenobiotic metabolite;
xenobiotic
iohexol[no description available]medium10benzenedicarboxamide;
organoiodine compound		environmental contaminant;
radioopaque medium;
xenobiotic
iodipamide[no description available]medium10benzoic acids;
organoiodine compound;
secondary carboxamide		radioopaque medium
avapro[no description available]medium10azaspiro compound;
biphenylyltetrazole		angiotensin receptor antagonist;
antihypertensive agent;
environmental contaminant;
xenobiotic
isoflurane[no description available]medium200organofluorine compoundinhalation anaesthetic
2-propanol[no description available]medium30secondary alcohol;
secondary fatty alcohol		protic solvent
isoxsuprine[no description available]medium10alkylbenzene
isradipine[no description available]medium10benzoxadiazole;
dihydropyridine;
isopropyl ester;
methyl ester
itraconazole[no description available]medium10piperazines
ketamine[no description available]high664cyclohexanones;
monochlorobenzenes;
secondary amino compound		analgesic;
environmental contaminant;
intravenous anaesthetic;
neurotoxin;
NMDA receptor antagonist;
xenobiotic
ketamine[no description available]high660cyclohexanones;
monochlorobenzenes;
secondary amino compound		analgesic;
environmental contaminant;
intravenous anaesthetic;
neurotoxin;
NMDA receptor antagonist;
xenobiotic
ketanserin[no description available]medium20aromatic ketone;
organofluorine compound;
piperidines;
quinazolines		alpha-adrenergic antagonist;
antihypertensive agent;
cardiovascular drug;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
serotonergic antagonist
ketoconazole[no description available]medium10dichlorobenzene;
dioxolane;
ether;
imidazoles;
N-acylpiperazine;
N-arylpiperazine
ketoprofen[no description available]high20benzophenones;
oxo monocarboxylic acid		antipyretic;
drug allergen;
EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
environmental contaminant;
non-steroidal anti-inflammatory drug;
xenobiotic
khellin[no description available]medium10furanochromone;
organic heterotricyclic compound;
oxacycle		anti-asthmatic agent;
bronchodilator agent;
cardiovascular drug;
vasodilator agent
lamotrigine[no description available]medium101,2,4-triazines;
dichlorobenzene;
primary arylamine		anticonvulsant;
antidepressant;
antimanic drug;
calcium channel blocker;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
environmental contaminant;
excitatory amino acid antagonist;
geroprotector;
non-narcotic analgesic;
xenobiotic
lansoprazole[no description available]medium10benzimidazoles;
pyridines;
sulfoxide		anti-ulcer drug;
EC 3.6.3.10 (H(+)/K(+)-exchanging ATPase) inhibitor
beta-lapachone[no description available]medium10benzochromenone;
orthoquinones		anti-inflammatory agent;
antineoplastic agent;
plant metabolite
leflunomide[no description available]medium10(trifluoromethyl)benzenes;
isoxazoles;
monocarboxylic acid amide		antineoplastic agent;
antiparasitic agent;
EC 1.3.98.1 [dihydroorotate oxidase (fumarate)] inhibitor;
EC 3.1.3.16 (phosphoprotein phosphatase) inhibitor;
hepatotoxic agent;
immunosuppressive agent;
non-steroidal anti-inflammatory drug;
prodrug;
pyrimidine synthesis inhibitor;
tyrosine kinase inhibitor
lofepramine[no description available]medium10aromatic ketone;
dibenzoazepine;
monochlorobenzenes;
tertiary amino compound		antidepressant
loperamide[no description available]medium10monocarboxylic acid amide;
monochlorobenzenes;
piperidines;
tertiary alcohol		anticoronaviral agent;
antidiarrhoeal drug;
mu-opioid receptor agonist
losartan[no description available]medium10biphenylyltetrazole;
imidazoles		angiotensin receptor antagonist;
anti-arrhythmia drug;
antihypertensive agent;
endothelin receptor antagonist
malathion[no description available]medium10diester;
ethyl ester;
organic thiophosphate
diisopropyl 1,3-dithiol-2-ylidenemalonate[no description available]medium20isopropyl ester
mazindol[no description available]medium10organic molecular entity
mebendazole[no description available]medium10aromatic ketone;
benzimidazoles;
carbamate ester		antinematodal drug;
microtubule-destabilising agent;
tubulin modulator
meclizine[no description available]medium10diarylmethane
meclofenoxate[no description available]medium20monocarboxylic acid
mefenamic acid[no description available]high30aminobenzoic acid;
secondary amino compound		analgesic;
antipyretic;
antirheumatic drug;
EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
environmental contaminant;
non-steroidal anti-inflammatory drug;
xenobiotic
vitamin k 3[no description available]medium101,4-naphthoquinones;
vitamin K		angiogenesis inhibitor;
antineoplastic agent;
EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor;
human urinary metabolite;
nutraceutical
meperidine[no description available]medium530ethyl ester;
piperidinecarboxylate ester;
tertiary amino compound		antispasmodic drug;
kappa-opioid receptor agonist;
mu-opioid receptor agonist;
opioid analgesic
meperidine[no description available]medium534ethyl ester;
piperidinecarboxylate ester;
tertiary amino compound		antispasmodic drug;
kappa-opioid receptor agonist;
mu-opioid receptor agonist;
opioid analgesic
mesalamine[no description available]medium10amino acid;
aromatic amine;
monocarboxylic acid;
monohydroxybenzoic acid;
phenols		non-steroidal anti-inflammatory drug
metformin[no description available]medium10guanidinesenvironmental contaminant;
geroprotector;
hypoglycemic agent;
xenobiotic
methadone[no description available]medium100benzenes;
diarylmethane;
ketone;
tertiary amino compound
methadone[no description available]medium101benzenes;
diarylmethane;
ketone;
tertiary amino compound
methoxsalen[no description available]medium10aromatic ether;
psoralens		antineoplastic agent;
cross-linking reagent;
dermatologic drug;
photosensitizing agent;
plant metabolite
methyprylon[no description available]medium10organic molecular entity
metoprolol[no description available]medium10aromatic ether;
propanolamine;
secondary alcohol;
secondary amino compound		antihypertensive agent;
beta-adrenergic antagonist;
environmental contaminant;
geroprotector;
xenobiotic
metyrapone[no description available]medium20aromatic ketoneantimetabolite;
diagnostic agent;
EC 1.14.15.4 (steroid 11beta-monooxygenase) inhibitor
mianserin[no description available]high20dibenzoazepineadrenergic uptake inhibitor;
alpha-adrenergic antagonist;
antidepressant;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
geroprotector;
H1-receptor antagonist;
histamine agonist;
sedative;
serotonergic antagonist
miconazole[no description available]medium10dichlorobenzene;
ether;
imidazoles
midazolam[no description available]high8421imidazobenzodiazepine;
monofluorobenzenes;
organochlorine compound		anticonvulsant;
antineoplastic agent;
anxiolytic drug;
apoptosis inducer;
central nervous system depressant;
GABAA receptor agonist;
general anaesthetic;
muscle relaxant;
sedative
midazolam[no description available]high840imidazobenzodiazepine;
monofluorobenzenes;
organochlorine compound		anticonvulsant;
antineoplastic agent;
anxiolytic drug;
apoptosis inducer;
central nervous system depressant;
GABAA receptor agonist;
general anaesthetic;
muscle relaxant;
sedative
mirtazapine[no description available]medium10benzazepine;
tetracyclic antidepressant		alpha-adrenergic antagonist;
anxiolytic drug;
H1-receptor antagonist;
histamine antagonist;
oneirogen;
serotonergic antagonist
mitotane[no description available]medium10diarylmethane
modafinil[no description available]medium10monocarboxylic acid amide;
sulfoxide
moxisylyte[no description available]medium20monoterpenoid
deet[no description available]medium10benzamides;
monocarboxylic acid amide		environmental contaminant;
insect repellent;
xenobiotic
nabumetone[no description available]medium10methoxynaphthalene;
methyl ketone		cyclooxygenase 2 inhibitor;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
prodrug
nefazodone[no description available]medium10aromatic ether;
monochlorobenzenes;
N-alkylpiperazine;
N-arylpiperazine;
triazoles		alpha-adrenergic antagonist;
analgesic;
antidepressant;
serotonergic antagonist;
serotonin uptake inhibitor
nevirapine[no description available]medium10cyclopropanes;
dipyridodiazepine		antiviral drug;
HIV-1 reverse transcriptase inhibitor
nialamide[no description available]medium10organonitrogen compound;
organooxygen compound
niceritrol[no description available]medium10organic molecular entity
niflumic acid[no description available]medium10aromatic carboxylic acid;
pyridines
nilutamide[no description available]medium10(trifluoromethyl)benzenes;
C-nitro compound;
imidazolidinone		androgen antagonist;
antineoplastic agent
nimesulide[no description available]medium10aromatic ether;
C-nitro compound;
sulfonamide		cyclooxygenase 2 inhibitor;
non-steroidal anti-inflammatory drug
nisoldipine[no description available]medium10C-nitro compound;
dicarboxylic acids and O-substituted derivatives;
diester;
dihydropyridine;
methyl ester
nitrazepam[no description available]high401,4-benzodiazepinone;
C-nitro compound		anticonvulsant;
antispasmodic drug;
drug metabolite;
GABA modulator;
sedative
nizatidine[no description available]medium101,3-thiazoles;
C-nitro compound;
carboxamidine;
organic sulfide;
tertiary amino compound		anti-ulcer drug;
cholinergic drug;
H2-receptor antagonist
masoprocol[no description available]medium10catechols;
lignan;
tetrol		antioxidant;
ferroptosis inhibitor;
geroprotector;
plant metabolite
norfloxacin[no description available]medium10fluoroquinolone antibiotic;
N-arylpiperazine;
quinolinemonocarboxylic acid;
quinolone antibiotic;
quinolone		antibacterial drug;
DNA synthesis inhibitor;
environmental contaminant;
xenobiotic
nortriptyline[no description available]medium20organic tricyclic compound;
secondary amine		adrenergic uptake inhibitor;
analgesic;
antidepressant;
antineoplastic agent;
apoptosis inducer;
drug metabolite
omeprazole[no description available]medium10aromatic ether;
benzimidazoles;
pyridines;
sulfoxide
ondansetron[no description available]medium10carbazoles
orphenadrine[no description available]medium30ether;
tertiary amino compound		antidyskinesia agent;
antiparkinson drug;
H1-receptor antagonist;
muscarinic antagonist;
muscle relaxant;
NMDA receptor antagonist;
parasympatholytic
oxamniquine[no description available]medium10aromatic primary alcohol;
C-nitro compound;
quinolines;
secondary amino compound
oxaprozin[no description available]medium101,3-oxazoles;
monocarboxylic acid		analgesic;
non-steroidal anti-inflammatory drug
oxazepam[no description available]high411,4-benzodiazepinone;
organochlorine compound		anxiolytic drug;
environmental contaminant;
xenobiotic
oxazepam[no description available]high401,4-benzodiazepinone;
organochlorine compound		anxiolytic drug;
environmental contaminant;
xenobiotic
oxethazaine[no description available]medium10amino acid amide
oxybenzone[no description available]medium10hydroxybenzophenone;
monomethoxybenzene		dermatologic drug;
environmental contaminant;
protective agent;
ultraviolet filter;
xenobiotic
oxyphenbutazone[no description available]medium40phenols;
pyrazolidines		antimicrobial agent;
antineoplastic agent;
antipyretic;
drug metabolite;
gout suppressant;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
xenobiotic metabolite
aminosalicylic acid[no description available]medium10aminobenzoic acid;
phenols		antitubercular agent
pantoprazole[no description available]medium10aromatic ether;
benzimidazoles;
organofluorine compound;
pyridines;
sulfoxide		anti-ulcer drug;
EC 3.6.3.10 (H(+)/K(+)-exchanging ATPase) inhibitor;
environmental contaminant;
xenobiotic
pemoline[no description available]medium101,3-oxazolescentral nervous system stimulant
pentobarbital[no description available]medium1950barbituratesGABAA receptor agonist
pentobarbital[no description available]medium1955barbituratesGABAA receptor agonist
pentoxifylline[no description available]medium10oxopurine
perazine[no description available]medium10N-alkylpiperazine;
N-methylpiperazine;
phenothiazines		dopaminergic antagonist;
phenothiazine antipsychotic drug
phenolphthalein[no description available]medium10phenols
phenoxybenzamine[no description available]medium40aromatic amine
phenylbutazone[no description available]medium60pyrazolidinesantirheumatic drug;
EC 1.1.1.184 [carbonyl reductase (NADPH)] inhibitor;
metabolite;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
peripheral nervous system drug
moxonidine[no description available]medium10organohalogen compound;
pyrimidines
pinacidil[no description available]medium10pyridines
pipemidic acid[no description available]medium10amino acid;
monocarboxylic acid;
N-arylpiperazine;
pyridopyrimidine;
quinolone antibiotic		antibacterial drug;
DNA synthesis inhibitor
piperazine[no description available]medium10azacycloalkane;
piperazines;
saturated organic heteromonocyclic parent		anthelminthic drug
praziquantel[no description available]medium10isoquinolines
prazosin[no description available]medium20aromatic ether;
furans;
monocarboxylic acid amide;
piperazines;
quinazolines		alpha-adrenergic antagonist;
antihypertensive agent;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor
prochlorperazine[no description available]high20N-alkylpiperazine;
N-methylpiperazine;
organochlorine compound;
phenothiazines		alpha-adrenergic antagonist;
antiemetic;
cholinergic antagonist;
dopamine receptor D2 antagonist;
dopaminergic antagonist;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
first generation antipsychotic
promethazine[no description available]high427phenothiazines;
tertiary amine		anti-allergic agent;
anticoronaviral agent;
antiemetic;
antipruritic drug;
H1-receptor antagonist;
local anaesthetic;
sedative
promethazine[no description available]high420phenothiazines;
tertiary amine		anti-allergic agent;
anticoronaviral agent;
antiemetic;
antipruritic drug;
H1-receptor antagonist;
local anaesthetic;
sedative
propofol[no description available]high180phenolsanticonvulsant;
antiemetic;
intravenous anaesthetic;
radical scavenger;
sedative
propranolol[no description available]high151naphthalenes;
propanolamine;
secondary amine		anti-arrhythmia drug;
antihypertensive agent;
anxiolytic drug;
beta-adrenergic antagonist;
environmental contaminant;
human blood serum metabolite;
vasodilator agent;
xenobiotic
propranolol[no description available]high150naphthalenes;
propanolamine;
secondary amine		anti-arrhythmia drug;
antihypertensive agent;
anxiolytic drug;
beta-adrenergic antagonist;
environmental contaminant;
human blood serum metabolite;
vasodilator agent;
xenobiotic
pyridinolcarbamate[no description available]medium20pyridines
pyrimethamine[no description available]medium160aminopyrimidine;
monochlorobenzenes		antimalarial;
antiprotozoal drug;
EC 1.5.1.3 (dihydrofolate reductase) inhibitor
opc 12759[no description available]medium10secondary carboxamide
riluzole[no description available]medium10benzothiazoles
risperidone[no description available]medium101,2-benzoxazoles;
heteroarylpiperidine;
organofluorine compound;
pyridopyrimidine		alpha-adrenergic antagonist;
dopaminergic antagonist;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
H1-receptor antagonist;
psychotropic drug;
second generation antipsychotic;
serotonergic antagonist
rofecoxib[no description available]medium10butenolide;
sulfone		analgesic;
cyclooxygenase 2 inhibitor;
non-steroidal anti-inflammatory drug
salicylamide[no description available]medium10phenols;
salicylamides		antirheumatic drug;
non-narcotic analgesic
sevoflurane[no description available]medium40ether;
organofluorine compound		central nervous system depressant;
inhalation anaesthetic;
platelet aggregation inhibitor
sibutramine[no description available]medium20organochlorine compound;
tertiary amino compound		anti-obesity agent;
serotonin uptake inhibitor
sotalol[no description available]high30ethanolamines;
secondary alcohol;
secondary amino compound;
sulfonamide		anti-arrhythmia drug;
beta-adrenergic antagonist;
environmental contaminant;
xenobiotic
4-phenylbutyric acid, sodium salt[no description available]medium10organic sodium saltEC 3.5.1.98 (histone deacetylase) inhibitor;
geroprotector;
neuroprotective agent;
orphan drug;
prodrug
vorinostat[no description available]medium10dicarboxylic acid diamide;
hydroxamic acid		antineoplastic agent;
apoptosis inducer;
EC 3.5.1.98 (histone deacetylase) inhibitor
sulfadimethoxine[no description available]medium10aromatic ether;
pyrimidines;
substituted aniline;
sulfonamide antibiotic;
sulfonamide		antiinfective agent;
antimicrobial agent;
drug allergen;
environmental contaminant;
xenobiotic
sulfamerazine[no description available]medium10pyrimidines;
sulfonamide antibiotic;
sulfonamide		antiinfective agent;
drug allergen
sulfameter[no description available]medium10pyrimidines;
sulfonamide antibiotic;
sulfonamide		antiinfective agent;
leprostatic drug;
renal agent
sulfamethizole[no description available]medium10sulfonamide antibiotic;
sulfonamide;
thiadiazoles		antiinfective agent;
antimicrobial agent;
drug allergen;
EC 2.5.1.15 (dihydropteroate synthase) inhibitor
sulfaphenazole[no description available]medium10primary amino compound;
pyrazoles;
substituted aniline;
sulfonamide antibiotic;
sulfonamide		antibacterial drug;
EC 1.14.13.181 (13-deoxydaunorubicin hydroxylase) inhibitor;
EC 1.14.13.67 (quinine 3-monooxygenase) inhibitor;
P450 inhibitor
sulfinpyrazone[no description available]medium20pyrazolidines;
sulfoxide		uricosuric drug
2-(octylamino)-1-[4-(propan-2-ylthio)phenyl]-1-propanol[no description available]medium10alkylbenzene
sulpiride[no description available]medium20benzamides;
N-alkylpyrrolidine;
sulfonamide		antidepressant;
antiemetic;
antipsychotic agent;
dopaminergic antagonist
suprofen[no description available]medium10aromatic ketone;
monocarboxylic acid;
thiophenes		antirheumatic drug;
drug allergen;
EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
peripheral nervous system drug
suramin[no description available]medium10naphthalenesulfonic acid;
phenylureas;
secondary carboxamide		angiogenesis inhibitor;
antinematodal drug;
antineoplastic agent;
apoptosis inhibitor;
EC 2.7.11.13 (protein kinase C) inhibitor;
GABA antagonist;
GABA-gated chloride channel antagonist;
purinergic receptor P2 antagonist;
ryanodine receptor agonist;
trypanocidal drug
gatifloxacin[no description available]medium10N-arylpiperazine;
organofluorine compound;
quinolinemonocarboxylic acid;
quinolone antibiotic;
quinolone		antiinfective agent;
antimicrobial agent;
EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor
temazepam[no description available]medium50benzodiazepine
temazepam[no description available]medium52benzodiazepine
temozolomide[no description available]medium10imidazotetrazine;
monocarboxylic acid amide;
triazene derivative		alkylating agent;
antineoplastic agent;
prodrug
terfenadine[no description available]medium10diarylmethane
thalidomide[no description available]medium60phthalimides;
piperidones
thioridazine[no description available]medium50phenothiazines;
piperidines		alpha-adrenergic antagonist;
dopaminergic antagonist;
EC 1.8.1.12 (trypanothione-disulfide reductase) inhibitor;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
first generation antipsychotic;
H1-receptor antagonist;
serotonergic antagonist
tiaprofenic acid[no description available]medium10aromatic ketone;
monocarboxylic acid;
thiophenes		drug allergen;
non-steroidal anti-inflammatory drug
ticlopidine[no description available]medium20monochlorobenzenes;
thienopyridine		anticoagulant;
fibrin modulating drug;
hematologic agent;
P2Y12 receptor antagonist;
platelet aggregation inhibitor
tiopronin[no description available]medium10N-acyl-amino acid
tizanidine[no description available]medium10benzothiadiazole;
imidazoles		alpha-adrenergic agonist;
muscle relaxant
tolperisone[no description available]medium10aromatic ketone
ultram[no description available]medium10aromatic ether;
tertiary alcohol;
tertiary amino compound
tranexamic acid[no description available]medium10amino acid
trazodone[no description available]high20monochlorobenzenes;
N-alkylpiperazine;
N-arylpiperazine;
triazolopyridine		adrenergic antagonist;
antidepressant;
anxiolytic drug;
H1-receptor antagonist;
sedative;
serotonin uptake inhibitor
triclosan[no description available]medium10aromatic ether;
dichlorobenzene;
monochlorobenzenes;
phenols		antibacterial agent;
antimalarial;
drug allergen;
EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor;
EC 1.5.1.3 (dihydrofolate reductase) inhibitor;
fungicide;
persistent organic pollutant;
xenobiotic
triflupromazine[no description available]medium40organofluorine compound;
phenothiazines;
tertiary amine		anticoronaviral agent;
antiemetic;
dopaminergic antagonist;
first generation antipsychotic
troglitazone[no description available]medium10chromanes;
thiazolidinone		anticoagulant;
anticonvulsant;
antineoplastic agent;
antioxidant;
EC 6.2.1.3 (long-chain-fatty-acid--CoA ligase) inhibitor;
ferroptosis inhibitor;
hypoglycemic agent;
platelet aggregation inhibitor;
vasodilator agent
venlafaxine[no description available]medium10cyclohexanols;
monomethoxybenzene;
tertiary alcohol;
tertiary amino compound		adrenergic uptake inhibitor;
analgesic;
antidepressant;
dopamine uptake inhibitor;
environmental contaminant;
serotonin uptake inhibitor;
xenobiotic
vesnarinone[no description available]medium10organic molecular entity
vigabatrin[no description available]medium20gamma-amino acidanticonvulsant;
EC 2.6.1.19 (4-aminobutyrate--2-oxoglutarate transaminase) inhibitor
ici 204,219[no description available]medium10carbamate ester;
indoles;
N-sulfonylcarboxamide		anti-asthmatic agent;
leukotriene antagonist
zolpidem[no description available]high30imidazopyridinecentral nervous system depressant;
GABA agonist;
sedative
guanidine hydrochloride[no description available]medium10one-carbon compound;
organic chloride salt		protein denaturant
hydrocortisone acetate[no description available]medium10cortisol ester;
tertiary alpha-hydroxy ketone
cortisone acetate[no description available]medium10corticosteroid hormone
mitomycin[no description available]medium40mitomycinalkylating agent;
antineoplastic agent
prednisolone[no description available]high3011beta-hydroxy steroid;
17alpha-hydroxy steroid;
20-oxo steroid;
21-hydroxy steroid;
3-oxo-Delta(1),Delta(4)-steroid;
C21-steroid;
glucocorticoid;
primary alpha-hydroxy ketone;
tertiary alpha-hydroxy ketone		adrenergic agent;
anti-inflammatory drug;
antineoplastic agent;
drug metabolite;
environmental contaminant;
immunosuppressive agent;
xenobiotic
estriol[no description available]medium1016alpha-hydroxy steroid;
17beta-hydroxy steroid;
3-hydroxy steroid		estrogen;
human metabolite;
human xenobiotic metabolite;
mouse metabolite
cephaloridine[no description available]medium10beta-lactam antibiotic allergen;
cephalosporin;
semisynthetic derivative		antibacterial drug
phentolamine[no description available]medium40imidazoles;
phenols;
substituted aniline;
tertiary amino compound		alpha-adrenergic antagonist;
vasodilator agent
sorbitol[no description available]high20glucitolcathartic;
Escherichia coli metabolite;
food humectant;
human metabolite;
laxative;
metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite;
sweetening agent
piperonyl butoxide[no description available]medium10benzodioxolespesticide synergist
bromouracil[no description available]medium10nucleobase analogue;
pyrimidines		mutagen
3,3',5-triiodothyroacetic acid[no description available]medium10
histamine dihydrochloride[no description available]medium10
thyroxine[no description available]high302-halophenol;
iodophenol;
L-phenylalanine derivative;
non-proteinogenic L-alpha-amino acid;
thyroxine zwitterion;
thyroxine		antithyroid drug;
human metabolite;
mouse metabolite;
thyroid hormone
dextroamphetamine[no description available]medium1501-phenylpropan-2-amineadrenergic agent;
adrenergic uptake inhibitor;
dopamine uptake inhibitor;
dopaminergic agent;
neurotoxin;
sympathomimetic agent
dextroamphetamine[no description available]medium1511-phenylpropan-2-amineadrenergic agent;
adrenergic uptake inhibitor;
dopamine uptake inhibitor;
dopaminergic agent;
neurotoxin;
sympathomimetic agent
carbachol[no description available]medium70ammonium salt;
carbamate ester		cardiotonic drug;
miotic;
muscarinic agonist;
nicotinic acetylcholine receptor agonist;
non-narcotic analgesic
norethindrone acetate[no description available]medium103-oxo-Delta(4) steroid;
acetate ester;
terminal acetylenic compound		progestin;
synthetic oral contraceptive
spironolactone[no description available]high203-oxo-Delta(4) steroid;
oxaspiro compound;
steroid lactone;
thioester		aldosterone antagonist;
antihypertensive agent;
diuretic;
environmental contaminant;
xenobiotic
cyclobarbital[no description available]medium10barbiturates
trichlorfon[no description available]high20organic phosphonate;
organochlorine compound;
phosphonic ester		agrochemical;
anthelminthic drug;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
EC 3.1.1.8 (cholinesterase) inhibitor;
insecticide
prednisone[no description available]medium3011-oxo steroid;
17alpha-hydroxy steroid;
20-oxo steroid;
21-hydroxy steroid;
3-oxo-Delta(1),Delta(4)-steroid;
C21-steroid;
glucocorticoid;
primary alpha-hydroxy ketone;
tertiary alpha-hydroxy ketone		adrenergic agent;
anti-inflammatory drug;
antineoplastic agent;
immunosuppressive agent;
prodrug
estrone[no description available]medium1017-oxo steroid;
3-hydroxy steroid;
phenolic steroid;
phenols		antineoplastic agent;
bone density conservation agent;
estrogen;
human metabolite;
mouse metabolite
oxandrolone[no description available]medium1017beta-hydroxy steroid;
3-oxo steroid;
anabolic androgenic steroid;
oxa-steroid		anabolic agent;
androgen
dehydroepiandrosterone[no description available]high2017-oxo steroid;
3beta-hydroxy-Delta(5)-steroid;
androstanoid		androgen;
human metabolite;
mouse metabolite
nad[no description available]medium10NADgeroprotector
pilocarpine[no description available]medium80pilocarpineantiglaucoma drug
triiodothyronine[no description available]high202-halophenol;
amino acid zwitterion;
iodophenol;
iodothyronine		human metabolite;
mouse metabolite;
thyroid hormone
glutamine[no description available]medium10amino acid zwitterion;
glutamine family amino acid;
glutamine;
L-alpha-amino acid;
polar amino acid zwitterion;
proteinogenic amino acid		EC 1.14.13.39 (nitric oxide synthase) inhibitor;
Escherichia coli metabolite;
human metabolite;
metabolite;
micronutrient;
mouse metabolite;
nutraceutical;
Saccharomyces cerevisiae metabolite
cetrimonium bromide[no description available]medium10organic bromide salt;
quaternary ammonium salt		detergent;
surfactant
sucrose[no description available]high40glycosyl glycosidealgal metabolite;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
osmolyte;
Saccharomyces cerevisiae metabolite;
sweetening agent
ethinyl estradiol[no description available]medium2017-hydroxy steroid;
3-hydroxy steroid;
terminal acetylenic compound		xenoestrogen
testosterone propionate[no description available]medium10steroid ester
apomorphine[no description available]medium200aporphine alkaloidalpha-adrenergic drug;
antidyskinesia agent;
antiparkinson drug;
dopamine agonist;
emetic;
serotonergic drug
aminopyrine[no description available]high60pyrazolone;
tertiary amino compound		antipyretic;
environmental contaminant;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
xenobiotic
methyltestosterone[no description available]medium1017beta-hydroxy steroid;
3-oxo-Delta(4) steroid;
enone		anabolic agent;
androgen;
antineoplastic agent
tetrabenazine[no description available]medium30benzoquinolizine;
cyclic ketone;
tertiary amino compound
uridine[no description available]medium10uridinesdrug metabolite;
fundamental metabolite;
human metabolite
kanamycin a[no description available]medium10kanamycinsbacterial metabolite
phenylephrine[no description available]medium20phenols;
phenylethanolamines;
secondary amino compound		alpha-adrenergic agonist;
cardiotonic drug;
mydriatic agent;
nasal decongestant;
protective agent;
sympathomimetic agent;
vasoconstrictor agent
carbaryl[no description available]medium10carbamate ester;
naphthalenes		acaricide;
agrochemical;
carbamate insecticide;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
EC 3.1.1.8 (cholinesterase) inhibitor;
plant growth retardant
lactose[no description available]medium20lactose
methionine[no description available]high30aspartate family amino acid;
L-alpha-amino acid;
methionine zwitterion;
methionine;
proteinogenic amino acid		antidote to paracetamol poisoning;
human metabolite;
micronutrient;
mouse metabolite;
nutraceutical
Mebutamate[no description available]medium10organic molecular entity
norethindrone[no description available]medium1017beta-hydroxy steroid;
3-oxo-Delta(4) steroid;
terminal acetylenic compound;
tertiary alcohol		progestin;
synthetic oral contraceptive
norethynodrel[no description available]medium10oxo steroid
benziodarone[no description available]medium10aromatic ketone
medroxyprogesterone acetate[no description available]medium1020-oxo steroid;
3-oxo-Delta(4) steroid;
acetate ester;
corticosteroid;
steroid ester		adjuvant;
androgen;
antineoplastic agent;
antioxidant;
female contraceptive drug;
inhibitor;
progestin;
synthetic oral contraceptive
mestranol[no description available]medium1017beta-hydroxy steroid;
aromatic ether;
terminal acetylenic compound		prodrug;
xenoestrogen
methaqualone[no description available]high306quinazolinesGABA agonist;
sedative
methaqualone[no description available]high300quinazolinesGABA agonist;
sedative
trypan blue[no description available]medium10
cordycepin[no description available]medium103'-deoxyribonucleoside;
adenosines		antimetabolite;
nucleoside antibiotic
tryptophan[no description available]high101erythrose 4-phosphate/phosphoenolpyruvate family amino acid;
L-alpha-amino acid zwitterion;
L-alpha-amino acid;
proteinogenic amino acid;
tryptophan zwitterion;
tryptophan		antidepressant;
Escherichia coli metabolite;
human metabolite;
micronutrient;
mouse metabolite;
nutraceutical;
plant metabolite;
Saccharomyces cerevisiae metabolite
tryptophan[no description available]high100erythrose 4-phosphate/phosphoenolpyruvate family amino acid;
L-alpha-amino acid zwitterion;
L-alpha-amino acid;
proteinogenic amino acid;
tryptophan zwitterion;
tryptophan		antidepressant;
Escherichia coli metabolite;
human metabolite;
micronutrient;
mouse metabolite;
nutraceutical;
plant metabolite;
Saccharomyces cerevisiae metabolite
arginine[no description available]high40arginine;
glutamine family amino acid;
L-alpha-amino acid;
proteinogenic amino acid		biomarker;
Escherichia coli metabolite;
micronutrient;
mouse metabolite;
nutraceutical
trichloroacetic acid[no description available]high750monocarboxylic acid;
organochlorine compound		carcinogenic agent;
metabolite;
mouse metabolite
triamcinolone acetonide[no description available]medium1011beta-hydroxy steroid;
20-oxo steroid;
21-hydroxy steroid;
3-oxo-Delta(4) steroid;
cyclic ketal;
fluorinated steroid;
glucocorticoid;
primary alpha-hydroxy ketone		anti-allergic agent;
anti-inflammatory drug
allylpropymal[no description available]medium10barbiturates
butobarbital[no description available]medium10barbiturates
trichloroethylene[no description available]high661chloroethenesinhalation anaesthetic;
mouse metabolite
trichloroethylene[no description available]high660chloroethenesinhalation anaesthetic;
mouse metabolite
dehydrocholic acid[no description available]medium1012-oxo steroid;
3-oxo-5beta-steroid;
7-oxo steroid;
oxo-5beta-cholanic acid		gastrointestinal drug
synephrine[no description available]medium10ethanolamines;
phenethylamine alkaloid;
phenols		alpha-adrenergic agonist;
plant metabolite
benzoyl peroxide[no description available]medium10carbonyl compound
furan[no description available]medium10furans;
mancude organic heteromonocyclic parent;
monocyclic heteroarene		carcinogenic agent;
hepatotoxic agent;
Maillard reaction product
neostigmine bromide[no description available]medium10bromide salt
phenformin[no description available]medium20biguanidesantineoplastic agent;
geroprotector;
hypoglycemic agent
mephobarbital[no description available]medium10barbituratesanticonvulsant
hexachlorobenzene[no description available]medium10aromatic fungicide;
chlorobenzenes		antifungal agrochemical;
carcinogenic agent;
persistent organic pollutant
trinitrotoluene[no description available]medium10trinitrotolueneexplosive
framycetin[no description available]medium20aminoglycosideallergen;
antibacterial drug;
Escherichia coli metabolite
framycetin[no description available]medium21aminoglycosideallergen;
antibacterial drug;
Escherichia coli metabolite
pyrazolanthrone[no description available]medium10anthrapyrazole;
aromatic ketone;
cyclic ketone		antineoplastic agent;
c-Jun N-terminal kinase inhibitor;
geroprotector
meglumine[no description available]medium10hexosamine;
secondary amino compound
cinchophen[no description available]medium10quinolines
yohimbine[no description available]medium80methyl 17-hydroxy-20xi-yohimban-16-carboxylatealpha-adrenergic antagonist;
dopamine receptor D2 antagonist;
serotonergic antagonist
mequinol[no description available]medium10methoxybenzenes;
phenols		metabolite
quinestrol[no description available]medium1017-hydroxy steroid;
terminal acetylenic compound		xenoestrogen
dydrogesterone[no description available]medium1020-oxo steroid;
3-oxo-Delta(4) steroid		progestin
ephedrine[no description available]high40phenethylamine alkaloid;
phenylethanolamines		bacterial metabolite;
environmental contaminant;
nasal decongestant;
plant metabolite;
sympathomimetic agent;
vasoconstrictor agent;
xenobiotic
chlormadinone acetate[no description available]medium10corticosteroid hormone
2,3-dimercaptosuccinic acid[no description available]medium10
evans blue[no description available]medium10organic sodium saltfluorochrome;
histological dye;
sodium channel blocker;
teratogenic agent
testosterone enanthate[no description available]medium10heptanoate ester;
sterol ester		androgen
aminophylline[no description available]medium20mixturebronchodilator agent;
cardiotonic drug
phenyramidol[no description available]medium10aminopyridine
nandrolone decanoate[no description available]medium10steroid ester
bucladesine[no description available]medium103',5'-cyclic purine nucleotide;
butanamides;
butyrate ester		agonist;
cardiotonic drug;
vasodilator agent
perflubron[no description available]medium10haloalkane;
organobromine compound;
perfluorinated compound		blood substitute;
radioopaque medium
cyproterone acetate[no description available]medium1020-oxo steroid;
3-oxo-Delta(4) steroid;
acetate ester;
chlorinated steroid;
steroid ester		androgen antagonist;
geroprotector;
progestin
dextropropoxyphene[no description available]medium301-benzyl-3-(dimethylamino)-2-methyl-1-phenylpropyl propanoatemu-opioid receptor agonist;
opioid analgesic
glycyrrhetinic acid[no description available]medium10cyclic terpene ketone;
hydroxy monocarboxylic acid;
pentacyclic triterpenoid		immunomodulator;
plant metabolite
chenodeoxycholic acid[no description available]medium10bile acid;
C24-steroid;
dihydroxy-5beta-cholanic acid		human metabolite;
mouse metabolite
dihydralazine[no description available]medium10phthalazines
phenylpropanolamine[no description available]medium10amphetamines;
phenethylamine alkaloid		plant metabolite
dihydroergotamine[no description available]medium10ergot alkaloid;
semisynthetic derivative		dopamine agonist;
non-narcotic analgesic;
serotonergic agonist;
sympatholytic agent;
vasoconstrictor agent
podophyllotoxin[no description available]medium10furonaphthodioxole;
lignan;
organic heterotetracyclic compound		antimitotic;
antineoplastic agent;
keratolytic drug;
microtubule-destabilising agent;
plant metabolite;
tubulin modulator
chlormethiazole[no description available]medium110thiazoles
chlormethiazole[no description available]medium111thiazoles
methamphetamine[no description available]high20amphetamines;
secondary amine		central nervous system stimulant;
environmental contaminant;
neurotoxin;
psychotropic drug;
xenobiotic
gentian violet[no description available]medium10organic chloride saltanthelminthic drug;
antibacterial agent;
antifungal agent;
antiseptic drug;
histological dye
hematoporphyrin[no description available]medium10
lactulose[no description available]medium10glycosylfructosegastrointestinal drug;
laxative
acetylcysteine[no description available]medium20acetylcysteine;
L-cysteine derivative;
N-acetyl-L-amino acid		antidote to paracetamol poisoning;
antiinfective agent;
antioxidant;
antiviral drug;
ferroptosis inhibitor;
geroprotector;
human metabolite;
mucolytic;
radical scavenger;
vulnerary
erythromycin stearate[no description available]medium10aminoglycoside
estradiol valerate[no description available]medium10steroid ester
vancomycin[no description available]medium10glycopeptideantibacterial drug;
antimicrobial agent;
bacterial metabolite
d-alpha tocopherol[no description available]medium20alpha-tocopherolalgal metabolite;
antiatherogenic agent;
anticoagulant;
antioxidant;
antiviral agent;
EC 2.7.11.13 (protein kinase C) inhibitor;
immunomodulator;
micronutrient;
nutraceutical;
plant metabolite
dronabinol[no description available]medium40benzochromene;
diterpenoid;
phytocannabinoid;
polyketide		cannabinoid receptor agonist;
epitope;
hallucinogen;
metabolite;
non-narcotic analgesic
amiloride[no description available]medium10aromatic amine;
guanidines;
organochlorine compound;
pyrazines		diuretic;
sodium channel blocker
pimozide[no description available]medium10benzimidazoles;
heteroarylpiperidine;
organofluorine compound		antidyskinesia agent;
dopaminergic antagonist;
first generation antipsychotic;
H1-receptor antagonist;
serotonergic antagonist
sulfadoxine[no description available]medium10pyrimidines;
sulfonamide		antibacterial drug;
antimalarial
acadesine[no description available]medium101-ribosylimidazolecarboxamide;
aminoimidazole;
nucleoside analogue		antineoplastic agent;
platelet aggregation inhibitor
stavudine[no description available]medium10dihydrofuran;
nucleoside analogue;
organic molecular entity		antimetabolite;
antiviral agent;
EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor
iproclozide[no description available]medium10aromatic ether
cladribine[no description available]medium10organochlorine compound;
purine 2'-deoxyribonucleoside		antineoplastic agent;
immunosuppressive agent
carbenicillin disodium[no description available]medium10organic sodium salt
dehydroemetine[no description available]medium10aromatic ether;
isoquinolines;
pyridoisoquinoline		antileishmanial agent;
antimalarial;
antiprotozoal drug
benorilate[no description available]medium10carbonyl compound
trimetazidine[no description available]medium10aromatic amine
vidarabine[no description available]medium10beta-D-arabinoside;
purine nucleoside		antineoplastic agent;
bacterial metabolite;
nucleoside antibiotic
tiadenol[no description available]medium10aliphatic sulfide
camptothecin[no description available]medium10delta-lactone;
pyranoindolizinoquinoline;
quinoline alkaloid;
tertiary alcohol		antineoplastic agent;
EC 5.99.1.2 (DNA topoisomerase) inhibitor;
genotoxin;
plant metabolite
stanozolol[no description available]medium1017beta-hydroxy steroid;
anabolic androgenic steroid;
organic heteropentacyclic compound;
tertiary alcohol		anabolic agent;
androgen
clodronic acid[no description available]medium101,1-bis(phosphonic acid);
one-carbon compound;
organochlorine compound		antineoplastic agent;
bone density conservation agent
levamisole[no description available]medium106-phenyl-2,3,5,6-tetrahydroimidazo[2,1-b][1,3]thiazoleantinematodal drug;
antirheumatic drug;
EC 3.1.3.1 (alkaline phosphatase) inhibitor;
immunological adjuvant;
immunomodulator
thiamphenicol[no description available]medium10monocarboxylic acid amide;
sulfone		antimicrobial agent;
immunosuppressive agent
pizotyline[no description available]medium10benzocycloheptathiophenehistamine antagonist;
muscarinic antagonist;
serotonergic antagonist
carbimazole[no description available]medium101,3-dihydroimidazole-2-thiones;
carbamate ester		antithyroid drug;
prodrug
oxyphenisatin[no description available]medium10indoles
tetrachloroethylene[no description available]medium60chlorocarbon;
chloroethenes		nephrotoxic agent
ursodeoxycholic acid[no description available]medium10bile acid;
C24-steroid;
dihydroxy-5beta-cholanic acid		human metabolite;
mouse metabolite
butachlor[no description available]high10aromatic amide;
organochlorine compound;
tertiary carboxamide		environmental contaminant;
herbicide;
xenobiotic
rose bengal b disodium salt[no description available]medium10
glutamic acid[no description available]high70glutamic acid;
glutamine family amino acid;
L-alpha-amino acid;
proteinogenic amino acid		Escherichia coli metabolite;
ferroptosis inducer;
micronutrient;
mouse metabolite;
neurotransmitter;
nutraceutical
nicergoline[no description available]medium20organic heterotetracyclic compound;
organonitrogen heterocyclic compound
oxcarbazepine[no description available]medium10cyclic ketone;
dibenzoazepine		anticonvulsant;
drug allergen
pirprofen[no description available]medium10pyrroline
ribavirin[no description available]medium101-ribosyltriazole;
aromatic amide;
monocarboxylic acid amide;
primary carboxamide		anticoronaviral agent;
antiinfective agent;
antimetabolite;
antiviral agent;
EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor
amikacin[no description available]medium10alpha-D-glucoside;
amino cyclitol glycoside;
aminoglycoside;
carboxamide		antibacterial drug;
antimicrobial agent;
nephrotoxin
ticrynafen[no description available]medium10aromatic ether;
aromatic ketone;
dichlorobenzene;
monocarboxylic acid;
thiophenes		antihypertensive agent;
hepatotoxic agent;
loop diuretic
bezafibrate[no description available]medium10aromatic ether;
monocarboxylic acid amide;
monocarboxylic acid;
monochlorobenzenes		antilipemic drug;
environmental contaminant;
geroprotector;
xenobiotic
diltiazem[no description available]medium105-[2-(dimethylamino)ethyl]-2-(4-methoxyphenyl)-4-oxo-2,3,4,5-tetrahydro-1,5-benzothiazepin-3-yl acetateantihypertensive agent;
calcium channel blocker;
vasodilator agent
benoxaprofen[no description available]medium101,3-benzoxazoles;
monocarboxylic acid;
monochlorobenzenes		antipsoriatic;
antipyretic;
EC 1.13.11.34 (arachidonate 5-lipoxygenase) inhibitor;
hepatotoxic agent;
nephrotoxin;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
protein kinase C agonist
permethrin[no description available]medium10cyclopropanecarboxylate ester;
cyclopropanes		agrochemical;
ectoparasiticide;
pyrethroid ester acaricide;
pyrethroid ester insecticide;
scabicide
pirfenidone[no description available]medium10pyridoneantipyretic;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug
desogestrel[no description available]medium1017beta-hydroxy steroid;
terminal acetylenic compound		contraceptive drug;
progestin;
synthetic oral contraceptive
muzolimine[no description available]medium10dichlorobenzene
epirubicin[no description available]medium10aminoglycoside;
anthracycline antibiotic;
anthracycline;
deoxy hexoside;
monosaccharide derivative;
p-quinones;
primary alpha-hydroxy ketone;
tertiary alpha-hydroxy ketone		antimicrobial agent;
antineoplastic agent;
EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor
desflurane[no description available]medium10organofluorine compoundinhalation anaesthetic
paroxetine[no description available]medium10aromatic ether;
benzodioxoles;
organofluorine compound;
piperidines		antidepressant;
anxiolytic drug;
hepatotoxic agent;
P450 inhibitor;
serotonin uptake inhibitor
cefoperazone[no description available]medium10cephalosporinantibacterial drug
foscarnet sodium[no description available]medium10one-carbon compound;
organic sodium salt		antiviral drug
moxalactam[no description available]medium10cephalosporin;
oxacephem		antibacterial drug
nicorandil[no description available]medium10nitrate ester;
pyridinecarboxamide		potassium channel opener;
vasodilator agent
cefadroxil anhydrous[no description available]medium10cephalosporinantibacterial drug
encainide[no description available]medium10benzamides;
piperidines		anti-arrhythmia drug;
sodium channel blocker
miglustat[no description available]medium10piperidines;
tertiary amino compound		anti-HIV agent;
EC 2.4.1.80 (ceramide glucosyltransferase) inhibitor
cefotetan[no description available]medium10
lovastatin[no description available]medium10delta-lactone;
fatty acid ester;
hexahydronaphthalenes;
polyketide;
statin (naturally occurring)		anticholesteremic drug;
antineoplastic agent;
Aspergillus metabolite;
prodrug
enoximone[no description available]medium10aromatic ketone
simvastatin[no description available]medium10delta-lactone;
fatty acid ester;
hexahydronaphthalenes;
statin (semi-synthetic)		EC 1.1.1.34/EC 1.1.1.88 (hydroxymethylglutaryl-CoA reductase) inhibitor;
EC 3.4.24.83 (anthrax lethal factor endopeptidase) inhibitor;
ferroptosis inducer;
geroprotector;
prodrug
pravastatin[no description available]medium103-hydroxy carboxylic acid;
carbobicyclic compound;
carboxylic ester;
hydroxy monocarboxylic acid;
secondary alcohol;
statin (semi-synthetic)		anticholesteremic drug;
environmental contaminant;
metabolite;
xenobiotic
atomoxetine hydrochloride[no description available]medium10hydrochlorideadrenergic uptake inhibitor;
antidepressant
gepirone[no description available]medium10N-arylpiperazine
mifepristone[no description available]medium103-oxo-Delta(4) steroid;
acetylenic compound;
tertiary amino compound		abortifacient;
contraceptive drug;
hormone antagonist;
synthetic oral contraceptive
sparfloxacin[no description available]medium10fluoroquinolone antibiotic;
N-arylpiperazine;
quinolinemonocarboxylic acid;
quinolone antibiotic;
quinolone
zileuton[no description available]medium101-benzothiophenes;
ureas		anti-asthmatic drug;
EC 1.13.11.34 (arachidonate 5-lipoxygenase) inhibitor;
ferroptosis inhibitor;
leukotriene antagonist;
non-steroidal anti-inflammatory drug
clopidogrel[no description available]medium20methyl ester;
monochlorobenzenes;
thienopyridine		anticoagulant;
P2Y12 receptor antagonist;
platelet aggregation inhibitor
cidofovir anhydrous[no description available]medium10phosphonic acids;
pyrimidone		anti-HIV agent;
antineoplastic agent;
antiviral drug;
photosensitizing agent
bromfenac[no description available]medium10aromatic amino acid;
benzophenones;
organobromine compound;
substituted aniline		non-narcotic analgesic;
non-steroidal anti-inflammatory drug
atorvastatin[no description available]medium10aromatic amide;
dihydroxy monocarboxylic acid;
monofluorobenzenes;
pyrroles;
statin (synthetic)		environmental contaminant;
xenobiotic
lamivudine[no description available]medium10monothioacetal;
nucleoside analogue;
oxacycle;
primary alcohol		allergen;
anti-HBV agent;
antiviral drug;
EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor;
HIV-1 reverse transcriptase inhibitor;
prodrug
duloxetine[no description available]medium10duloxetine
irinotecan[no description available]medium20carbamate ester;
delta-lactone;
N-acylpiperidine;
pyranoindolizinoquinoline;
ring assembly;
tertiary alcohol;
tertiary amino compound		antineoplastic agent;
apoptosis inducer;
EC 5.99.1.2 (DNA topoisomerase) inhibitor;
prodrug
valsartan[no description available]medium10biphenylyltetrazole;
monocarboxylic acid amide;
monocarboxylic acid		angiotensin receptor antagonist;
antihypertensive agent;
environmental contaminant;
xenobiotic
adefovir dipivoxil[no description available]medium106-aminopurines;
carbonate ester;
ether;
organic phosphonate		antiviral drug;
DNA synthesis inhibitor;
HIV-1 reverse transcriptase inhibitor;
nephrotoxic agent;
prodrug
capecitabine[no description available]medium10carbamate ester;
cytidines;
organofluorine compound		antimetabolite;
antineoplastic agent;
prodrug
adenosine[no description available]medium10adenosines;
purines D-ribonucleoside		analgesic;
anti-arrhythmia drug;
fundamental metabolite;
human metabolite;
vasodilator agent
halofuginone[no description available]medium10quinazolines
ortho-cept[no description available]medium10
cefprozil[no description available]medium10cephalosporin;
semisynthetic derivative		antibacterial drug
4-[1-[4-[2-(dimethylamino)ethoxy]phenyl]-2-phenylbut-1-enyl]phenol[no description available]medium10stilbenoid
efavirenz[no description available]medium10acetylenic compound;
benzoxazine;
cyclopropanes;
organochlorine compound;
organofluorine compound		antiviral drug;
HIV-1 reverse transcriptase inhibitor
nelfinavir[no description available]medium10aryl sulfide;
benzamides;
organic heterobicyclic compound;
phenols;
secondary alcohol;
tertiary amino compound		antineoplastic agent;
HIV protease inhibitor
doxapram hydrochloride[no description available]medium10hydrochloridecentral nervous system stimulant
1,5-anhydroglucitol[no description available]medium10anhydro sugarhuman metabolite
betulinic acid[no description available]medium10hydroxy monocarboxylic acid;
pentacyclic triterpenoid		anti-HIV agent;
anti-inflammatory agent;
antimalarial;
antineoplastic agent;
EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor;
plant metabolite
amprenavir[no description available]medium10carbamate ester;
sulfonamide;
tetrahydrofuryl ester		antiviral drug;
HIV protease inhibitor
glutathione disulfide[no description available]medium10glutathione derivative;
organic disulfide		Escherichia coli metabolite;
mouse metabolite
erdosteine[no description available]medium10N-acyl-amino acid
mizolastine[no description available]medium10benzimidazoles
intoplicine[no description available]medium10pyridoindole
telmisartan[no description available]medium10benzimidazoles;
biphenyls;
carboxybiphenyl		angiotensin receptor antagonist;
antihypertensive agent;
EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor;
environmental contaminant;
xenobiotic
2-methoxyestradiol[no description available]medium1017beta-hydroxy steroid;
3-hydroxy steroid		angiogenesis modulating agent;
antimitotic;
antineoplastic agent;
human metabolite;
metabolite;
mouse metabolite
medetomidine[no description available]medium20imidazoles
sertraline[no description available]medium10dichlorobenzene;
secondary amino compound;
tetralins		antidepressant;
serotonin uptake inhibitor
picosulfate sodium[no description available]medium10aryl sulfate;
pyridines
dienogest[no description available]medium1017beta-hydroxy steroid;
3-oxo-Delta(4) steroid;
aliphatic nitrile;
steroid hormone		progesterone receptor agonist;
progestin;
synthetic oral contraceptive
morphazinamide[no description available]medium10morpholines;
pyrazines;
secondary carboxamide
dexrazoxane[no description available]medium10razoxaneantineoplastic agent;
cardiovascular drug;
chelator;
immunosuppressive agent
voriconazole[no description available]medium10conazole antifungal drug;
difluorobenzene;
pyrimidines;
tertiary alcohol;
triazole antifungal drug		P450 inhibitor
cyclobutyrol[no description available]medium10hydroxy monocarboxylic acidbile therapy drug
terlipressin[no description available]medium10polypeptide
isoflavone[no description available]medium10isoflavones
clevudine[no description available]medium10
tetrandrine[no description available]medium10bisbenzylisoquinoline alkaloid;
isoquinolines
rosiglitazone[no description available]medium10aminopyridine;
thiazolidinediones		EC 6.2.1.3 (long-chain-fatty-acid--CoA ligase) inhibitor;
ferroptosis inhibitor;
insulin-sensitizing drug
clarithromycin[no description available]medium10macrolide antibioticantibacterial drug;
environmental contaminant;
protein synthesis inhibitor;
xenobiotic
nicotine[no description available]high1803-(1-methylpyrrolidin-2-yl)pyridineanxiolytic drug;
biomarker;
immunomodulator;
mitogen;
neurotoxin;
nicotinic acetylcholine receptor agonist;
peripheral nervous system drug;
phytogenic insecticide;
plant metabolite;
psychotropic drug;
teratogenic agent;
xenobiotic
lopinavir[no description available]medium10amphetamines;
dicarboxylic acid diamide		anticoronaviral agent;
antiviral drug;
HIV protease inhibitor
sr141716[no description available]medium10amidopiperidine;
carbohydrazide;
dichlorobenzene;
monochlorobenzenes;
pyrazoles		anti-obesity agent;
appetite depressant;
CB1 receptor antagonist
bosentan anhydrous[no description available]medium10primary alcohol;
pyrimidines;
sulfonamide		antihypertensive agent;
endothelin receptor antagonist
selenomethionine[no description available]medium10amino acid zwitterion;
selenomethionine		plant metabolite
fingolimod[no description available]medium10aminodiol;
primary amino compound		antineoplastic agent;
CB1 receptor antagonist;
immunosuppressive agent;
prodrug;
sphingosine-1-phosphate receptor agonist
ecteinascidin 743[no description available]medium10acetate ester;
azaspiro compound;
bridged compound;
hemiaminal;
isoquinoline alkaloid;
lactone;
organic heteropolycyclic compound;
organic sulfide;
oxaspiro compound;
polyphenol;
tertiary amino compound		alkylating agent;
angiogenesis modulating agent;
anti-inflammatory agent;
antineoplastic agent;
marine metabolite
nitisinone[no description available]medium10(trifluoromethyl)benzenes;
C-nitro compound;
cyclohexanones;
mesotrione		EC 1.13.11.27 (4-hydroxyphenylpyruvate dioxygenase) inhibitor
marimastat[no description available]medium10hydroxamic acid;
secondary carboxamide		antineoplastic agent;
matrix metalloproteinase inhibitor
clofarabine[no description available]medium10adenosines;
organofluorine compound		antimetabolite;
antineoplastic agent
mitiglinide[no description available]medium10benzenes;
monocarboxylic acid
imatinib mesylate[no description available]medium10methanesulfonate saltanticoronaviral agent;
antineoplastic agent;
apoptosis inducer;
tyrosine kinase inhibitor
gefitinib[no description available]medium10aromatic ether;
monochlorobenzenes;
monofluorobenzenes;
morpholines;
quinazolines;
secondary amino compound;
tertiary amino compound		antineoplastic agent;
epidermal growth factor receptor antagonist
n(6)-(3-iodobenzyl)-5'-n-methylcarboxamidoadenosine[no description available]medium10adenosines;
monocarboxylic acid amide;
organoiodine compound		adenosine A3 receptor agonist
antiprimod[no description available]medium10
sulbactam[no description available]medium10penicillanic acids
olmesartan medoxomil[no description available]medium10biphenyls
ilomastat[no description available]medium10hydroxamic acid;
L-tryptophan derivative;
N-acyl-amino acid		anti-inflammatory agent;
antibacterial agent;
antineoplastic agent;
EC 3.4.24.24 (gelatinase A) inhibitor;
neuroprotective agent
docetaxel[no description available]medium10hydrate;
secondary alpha-hydroxy ketone		antineoplastic agent
atazanavir[no description available]medium10carbohydrazideantiviral drug;
HIV protease inhibitor
levofloxacin[no description available]medium109-fluoro-3-methyl-10-(4-methylpiperazin-1-yl)-7-oxo-2,3-dihydro-7H-[1,4]oxazino[2,3,4-ij]quinoline-6-carboxylic acid;
fluoroquinolone antibiotic;
quinolone antibiotic		antibacterial drug;
DNA synthesis inhibitor;
EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor;
topoisomerase IV inhibitor
ezetimibe[no description available]medium10azetidines;
beta-lactam;
organofluorine compound		anticholesteremic drug;
antilipemic drug;
antimetabolite
cariporide[no description available]medium10
tezosentan[no description available]medium10
moxifloxacin[no description available]medium10aromatic ether;
cyclopropanes;
fluoroquinolone antibiotic;
pyrrolidinopiperidine;
quinolinemonocarboxylic acid;
quinolone antibiotic;
quinolone		antibacterial drug
jtt 501[no description available]medium10
naproxen[no description available]medium10methoxynaphthalene;
monocarboxylic acid		antipyretic;
cyclooxygenase 1 inhibitor;
cyclooxygenase 2 inhibitor;
drug allergen;
environmental contaminant;
gout suppressant;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
xenobiotic
cyc 202[no description available]medium102,6-diaminopurinesantiviral drug;
EC 2.7.11.22 (cyclin-dependent kinase) inhibitor
paromomycin[no description available]medium10amino cyclitol glycoside;
aminoglycoside antibiotic		anthelminthic drug;
antibacterial drug;
antiparasitic agent;
antiprotozoal drug
avasimibe[no description available]medium10monoterpenoid
biotin[no description available]medium10biotins;
vitamin B7		coenzyme;
cofactor;
Escherichia coli metabolite;
fundamental metabolite;
human metabolite;
mouse metabolite;
nutraceutical;
prosthetic group;
Saccharomyces cerevisiae metabolite
troleandomycin[no description available]medium10acetate ester;
epoxide;
macrolide antibiotic;
monosaccharide derivative;
polyketide;
semisynthetic derivative		EC 1.14.13.97 (taurochenodeoxycholate 6alpha-hydroxylase) inhibitor;
xenobiotic
deferasirox[no description available]medium10benzoic acids;
monocarboxylic acid;
phenols;
triazoles		iron chelator
tbc-11251[no description available]medium10benzodioxoles
sitosterol, (3beta)-isomer[no description available]medium103beta-hydroxy-Delta(5)-steroid;
3beta-sterol;
C29-steroid;
phytosterols;
stigmastane sterol		anticholesteremic drug;
antioxidant;
mouse metabolite;
plant metabolite;
sterol methyltransferase inhibitor
benzarone[no description available]medium101-benzofurans
noscapine[no description available]medium10aromatic ether;
benzylisoquinoline alkaloid;
cyclic acetal;
isobenzofuranone;
organic heterobicyclic compound;
organic heterotricyclic compound;
tertiary amino compound		antineoplastic agent;
antitussive;
apoptosis inducer;
plant metabolite
homoharringtonine[no description available]medium10alkaloid ester;
enol ether;
organic heteropentacyclic compound;
tertiary alcohol		anticoronaviral agent;
antineoplastic agent;
apoptosis inducer;
protein synthesis inhibitor
o-(chloroacetylcarbamoyl)fumagillol[no description available]medium10carbamate ester;
organochlorine compound;
semisynthetic derivative;
sesquiterpenoid;
spiro-epoxide		angiogenesis inhibitor;
antineoplastic agent;
EC 1.5.1.3 (dihydrofolate reductase) inhibitor;
methionine aminopeptidase 2 inhibitor;
retinoic acid receptor alpha antagonist
bortezomib[no description available]medium10amino acid amide;
L-phenylalanine derivative;
pyrazines		antineoplastic agent;
antiprotozoal drug;
protease inhibitor;
proteasome inhibitor
ritonavir[no description available]medium101,3-thiazoles;
carbamate ester;
carboxamide;
L-valine derivative;
ureas		antiviral drug;
environmental contaminant;
HIV protease inhibitor;
xenobiotic
nexavar[no description available]medium10organosulfonate salt
glucosamine[no description available]medium10D-glucosamineEscherichia coli metabolite;
geroprotector;
mouse metabolite
quinidine[no description available]medium30cinchona alkaloidalpha-adrenergic antagonist;
anti-arrhythmia drug;
antimalarial;
drug allergen;
EC 1.14.13.181 (13-deoxydaunorubicin hydroxylase) inhibitor;
EC 3.6.3.44 (xenobiotic-transporting ATPase) inhibitor;
muscarinic antagonist;
P450 inhibitor;
potassium channel blocker;
sodium channel blocker
meropenem[no description available]medium10alpha,beta-unsaturated monocarboxylic acid;
carbapenemcarboxylic acid;
organic sulfide;
pyrrolidinecarboxamide		antibacterial agent;
antibacterial drug;
drug allergen
griseofulvin[no description available]high601-benzofurans;
antibiotic antifungal drug;
benzofuran antifungal drug;
organochlorine compound;
oxaspiro compound		antibacterial agent;
Penicillium metabolite
saquinavir[no description available]medium10L-asparagine derivative;
quinolines		antiviral drug;
HIV protease inhibitor
trimethaphan camsylate[no description available]medium10
erythromycin estolate[no description available]medium10aminoglycoside sulfate salt;
erythromycin derivative		enzyme inhibitor
cyclopamine[no description available]medium10piperidinesglioma-associated oncogene inhibitor
devazepide[no description available]medium101,4-benzodiazepinone;
indolecarboxamide		antineoplastic agent;
apoptosis inducer;
cholecystokinin antagonist;
gastrointestinal drug
tolterodine[no description available]medium10tertiary amineantispasmodic drug;
muscarinic antagonist;
muscle relaxant
doxorubicin hydrochloride[no description available]medium10anthracycline
erythromycin ethylsuccinate[no description available]medium10cyclic ketone;
erythromycin derivative;
ethyl ester;
succinate ester
ao 128[no description available]medium10organic molecular entity
acarbose[no description available]medium10amino cyclitol;
glycoside
tretinoin[no description available]medium20retinoic acid;
vitamin A		anti-inflammatory agent;
antineoplastic agent;
antioxidant;
AP-1 antagonist;
human metabolite;
keratolytic drug;
retinoic acid receptor agonist;
retinoid X receptor agonist;
signalling molecule
alpha-D-fructofuranose 1,6-bisphosphate[no description available]medium10D-fructofuranose 1,6-bisphosphate
docosahexaenoate[no description available]medium10docosahexaenoic acid;
omega-3 fatty acid		algal metabolite;
antineoplastic agent;
Daphnia tenebrosa metabolite;
human metabolite;
mouse metabolite;
nutraceutical
oleic acid[no description available]medium10octadec-9-enoic acidantioxidant;
Daphnia galeata metabolite;
EC 3.1.1.1 (carboxylesterase) inhibitor;
Escherichia coli metabolite;
mouse metabolite;
plant metabolite;
solvent
tacrolimus[no description available]medium10macrolide lactambacterial metabolite;
immunosuppressive agent
cerivastatin[no description available]medium10dihydroxy monocarboxylic acid;
pyridines;
statin (synthetic)
rosuvastatin[no description available]medium10dihydroxy monocarboxylic acid;
monofluorobenzenes;
pyrimidines;
statin (synthetic);
sulfonamide		anti-inflammatory agent;
antilipemic drug;
cardioprotective agent;
CETP inhibitor;
environmental contaminant;
xenobiotic
cocaine[no description available]high150benzoate ester;
methyl ester;
tertiary amino compound;
tropane alkaloid		adrenergic uptake inhibitor;
central nervous system stimulant;
dopamine uptake inhibitor;
environmental contaminant;
local anaesthetic;
mouse metabolite;
plant metabolite;
serotonin uptake inhibitor;
sodium channel blocker;
sympathomimetic agent;
vasoconstrictor agent;
xenobiotic
eicosapentaenoic acid[no description available]medium10icosapentaenoic acid;
omega-3 fatty acid		anticholesteremic drug;
antidepressant;
antineoplastic agent;
Daphnia galeata metabolite;
fungal metabolite;
micronutrient;
mouse metabolite;
nutraceutical
zithromax[no description available]medium10macrolide antibioticantibacterial drug;
environmental contaminant;
xenobiotic
drf 2725[no description available]medium10
diethylstilbestrol[no description available]medium80olefinic compound;
polyphenol		antifungal agent;
antineoplastic agent;
autophagy inducer;
calcium channel blocker;
carcinogenic agent;
EC 1.1.1.146 (11beta-hydroxysteroid dehydrogenase) inhibitor;
EC 3.6.3.10 (H(+)/K(+)-exchanging ATPase) inhibitor;
endocrine disruptor;
xenoestrogen
alitretinoin[no description available]medium10retinoic acidantineoplastic agent;
keratolytic drug;
metabolite;
retinoid X receptor agonist
decitabine[no description available]medium102'-deoxyribonucleoside
dactinomycin[no description available]medium30actinomycinmutagen
tenofovir[no description available]medium10nucleoside analogue;
phosphonic acids		antiviral drug;
drug metabolite;
HIV-1 reverse transcriptase inhibitor
rubitecan[no description available]medium10C-nitro compound;
delta-lactone;
pyranoindolizinoquinoline;
semisynthetic derivative;
tertiary alcohol		antineoplastic agent;
EC 5.99.1.2 (DNA topoisomerase) inhibitor;
prodrug
micafungin[no description available]medium10antibiotic antifungal drug;
echinocandin		antiinfective agent
riboflavin[no description available]medium10flavin;
vitamin B2		anti-inflammatory agent;
antioxidant;
cofactor;
Escherichia coli metabolite;
food colouring;
fundamental metabolite;
human urinary metabolite;
mouse metabolite;
photosensitizing agent;
plant metabolite
sodium bicarbonate[no description available]medium10one-carbon compound;
organic sodium salt		antacid;
food anticaking agent
sodium acetate, anhydrous[no description available]medium10organic sodium saltNMR chemical shift reference compound
sodium benzoate[no description available]medium10organic sodium saltalgal metabolite;
antimicrobial food preservative;
drug allergen;
EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor;
EC 3.1.1.3 (triacylglycerol lipase) inhibitor;
human xenobiotic metabolite;
plant metabolite
ditiocarb sodium[no description available]medium10organic molecular entity
discodermolide[no description available]medium10diterpenoid
cannabidiol[no description available]medium10olefinic compound;
phytocannabinoid;
resorcinols		antimicrobial agent;
plant metabolite
prothionamide[no description available]medium10pyridines
etomidate[no description available]high30ethyl ester;
imidazoles		intravenous anaesthetic;
sedative
sulindac[no description available]medium10monocarboxylic acid;
organofluorine compound;
sulfoxide		analgesic;
antineoplastic agent;
antipyretic;
apoptosis inducer;
EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
prodrug;
tocolytic agent
capsaicin[no description available]medium10capsaicinoidnon-narcotic analgesic;
TRPV1 agonist;
voltage-gated sodium channel blocker
terbinafine[no description available]medium10acetylenic compound;
allylamine antifungal drug;
enyne;
naphthalenes;
tertiary amine		EC 1.14.13.132 (squalene monooxygenase) inhibitor;
P450 inhibitor;
sterol biosynthesis inhibitor
tacrine hydrochloride[no description available]medium10
sodium propionate[no description available]medium10organic sodium saltantifungal drug;
food preservative
tamoxifen[no description available]medium10stilbenoid;
tertiary amino compound		angiogenesis inhibitor;
antineoplastic agent;
bone density conservation agent;
EC 1.2.3.1 (aldehyde oxidase) inhibitor;
EC 2.7.11.13 (protein kinase C) inhibitor;
estrogen antagonist;
estrogen receptor antagonist;
estrogen receptor modulator
fusidic acid[no description available]medium1011alpha-hydroxy steroid;
3alpha-hydroxy steroid;
alpha,beta-unsaturated monocarboxylic acid;
steroid acid;
steroid antibiotic;
sterol ester		EC 2.7.1.33 (pantothenate kinase) inhibitor;
Escherichia coli metabolite;
protein synthesis inhibitor
estrone sulfate[no description available]medium1017-oxo steroid;
steroid sulfate		human metabolite;
mouse metabolite
hmr 3647[no description available]medium10
toremifene[no description available]medium10aromatic ether;
organochlorine compound;
tertiary amine		antineoplastic agent;
bone density conservation agent;
estrogen antagonist;
estrogen receptor modulator
telaprevir[no description available]medium10cyclopentapyrrole;
cyclopropanes;
oligopeptide;
pyrazines		antiviral drug;
hepatitis C protease inhibitor;
peptidomimetic
droloxifene[no description available]medium10stilbenoid
or 1259[no description available]medium10hydrazone;
nitrile;
pyridazinone		anti-arrhythmia drug;
cardiotonic drug;
EC 3.1.4.17 (3',5'-cyclic-nucleotide phosphodiesterase) inhibitor;
vasodilator agent
orlistat[no description available]medium10beta-lactone;
carboxylic ester;
formamides;
L-leucine derivative		anti-obesity agent;
bacterial metabolite;
EC 2.3.1.85 (fatty acid synthase) inhibitor;
EC 3.1.1.3 (triacylglycerol lipase) inhibitor
idoxifene[no description available]medium10stilbenoid
zd 6474[no description available]medium10aromatic ether;
organobromine compound;
organofluorine compound;
piperidines;
quinazolines;
secondary amine		antineoplastic agent;
tyrosine kinase inhibitor
silybin[no description available]medium10
chloramine-t[no description available]medium10organic sodium saltallergen;
antifouling biocide;
disinfectant
flosequinan[no description available]medium10quinolines
tolcapone[no description available]medium202-nitrophenols;
benzophenones;
catechols		antiparkinson drug;
EC 2.1.1.6 (catechol O-methyltransferase) inhibitor
dinoprostone[no description available]high20prostaglandins Ehuman metabolite;
mouse metabolite;
oxytocic
dinoprost[no description available]high30monocarboxylic acid;
prostaglandins Falpha		human metabolite;
mouse metabolite
calcitriol[no description available]medium10D3 vitamins;
hydroxycalciol;
triol		antineoplastic agent;
antipsoriatic;
bone density conservation agent;
calcium channel agonist;
calcium channel modulator;
hormone;
human metabolite;
immunomodulator;
metabolite;
mouse metabolite;
nutraceutical
beta carotene[no description available]medium10carotenoid beta-end derivative;
cyclic carotene		antioxidant;
biological pigment;
cofactor;
ferroptosis inhibitor;
human metabolite;
mouse metabolite;
plant metabolite;
provitamin A
cholecalciferol[no description available]medium10D3 vitamins;
hydroxy seco-steroid;
seco-cholestane;
secondary alcohol;
steroid hormone		geroprotector;
human metabolite
clavulanic acid[no description available]medium10oxapenamantibacterial drug;
anxiolytic drug;
bacterial metabolite;
EC 3.5.2.6 (beta-lactamase) inhibitor
pulmicort[no description available]medium1011beta-hydroxy steroid;
20-oxo steroid;
21-hydroxy steroid;
3-oxo-Delta(1),Delta(4)-steroid;
cyclic acetal;
glucocorticoid;
primary alpha-hydroxy ketone		anti-inflammatory drug;
bronchodilator agent;
drug allergen
oxymetholone[no description available]medium10
montelukast[no description available]medium10aliphatic sulfide;
monocarboxylic acid;
quinolines		anti-arrhythmia drug;
anti-asthmatic drug;
leukotriene antagonist
mycophenolate mofetil[no description available]medium10carboxylic ester;
ether;
gamma-lactone;
phenols;
tertiary amino compound		anticoronaviral agent;
EC 1.1.1.205 (IMP dehydrogenase) inhibitor;
immunosuppressive agent;
prodrug
entacapone[no description available]medium202-nitrophenols;
catechols;
monocarboxylic acid amide;
nitrile		antidyskinesia agent;
antiparkinson drug;
central nervous system drug;
EC 2.1.1.6 (catechol O-methyltransferase) inhibitor
astaxanthine[no description available]medium10carotenol;
carotenone		animal metabolite;
anticoagulant;
antioxidant;
food colouring;
plant metabolite
diosmin[no description available]medium10dihydroxyflavanone;
disaccharide derivative;
glycosyloxyflavone;
monomethoxyflavone;
rutinoside		anti-inflammatory agent;
antioxidant
sdz psc 833[no description available]medium10homodetic cyclic peptide
coenzyme q10[no description available]medium10ubiquinonesantioxidant;
ferroptosis inhibitor;
human metabolite
tranilast[no description available]medium10amidobenzoic acid;
cinnamamides;
dimethoxybenzene;
secondary carboxamide		anti-allergic agent;
anti-asthmatic drug;
antineoplastic agent;
aryl hydrocarbon receptor agonist;
calcium channel blocker;
hepatoprotective agent;
nephroprotective agent
etretinate[no description available]medium10enoate ester;
ethyl ester;
retinoid		keratolytic drug
isotretinoin[no description available]medium10retinoic acidantineoplastic agent;
keratolytic drug;
teratogenic agent
misoprostol[no description available]medium10
ozagrel[no description available]medium10cinnamic acids
pitavastatin[no description available]medium10cyclopropanes;
dihydroxy monocarboxylic acid;
monofluorobenzenes;
quinolines;
statin (synthetic)		antioxidant
alatrofloxacin mesylate[no description available]medium10
natamycin[no description available]medium10antibiotic antifungal drug;
dicarboxylic acid monoester;
epoxide;
macrolide antibiotic;
monosaccharide derivative;
polyene antibiotic		antifungal agrochemical;
antimicrobial food preservative;
apoptosis inducer;
bacterial metabolite;
ophthalmology drug
acitretin[no description available]medium10acitretin;
alpha,beta-unsaturated monocarboxylic acid;
retinoid		keratolytic drug
dothiepin[no description available]medium10dothiepin
levetiracetam[no description available]medium10pyrrolidin-2-onesanticonvulsant;
environmental contaminant;
xenobiotic
nalorphine[no description available]medium50morphinane alkaloid
oxymorphone[no description available]medium10morphinane alkaloid
sirolimus[no description available]medium20antibiotic antifungal drug;
cyclic acetal;
cyclic ketone;
ether;
macrolide lactam;
organic heterotricyclic compound;
secondary alcohol		antibacterial drug;
anticoronaviral agent;
antineoplastic agent;
bacterial metabolite;
geroprotector;
immunosuppressive agent;
mTOR inhibitor
topiramate[no description available]medium10cyclic ketal;
ketohexose derivative;
sulfamate ester		anticonvulsant;
sodium channel blocker
alvocidib[no description available]medium10dihydroxyflavone;
hydroxypiperidine;
monochlorobenzenes;
tertiary amino compound		antineoplastic agent;
antirheumatic drug;
apoptosis inducer;
EC 2.7.11.22 (cyclin-dependent kinase) inhibitor
seocalcitol[no description available]medium10
fenretinide[no description available]medium10monocarboxylic acid amide;
retinoid		antineoplastic agent;
antioxidant
geldanamycin[no description available]medium101,4-benzoquinones;
ansamycin;
carbamate ester;
organic heterobicyclic compound		antimicrobial agent;
antineoplastic agent;
antiviral agent;
cysteine protease inhibitor;
Hsp90 inhibitor
demycarosylturimycin h[no description available]medium10
iloprost[no description available]medium10carbobicyclic compound;
monocarboxylic acid;
secondary alcohol		platelet aggregation inhibitor;
vasodilator agent
furazolidone[no description available]medium10
fluvoxamine[no description available]medium10(trifluoromethyl)benzenes;
5-methoxyvalerophenone O-(2-aminoethyl)oxime		antidepressant;
anxiolytic drug;
serotonin uptake inhibitor
semaxinib[no description available]medium10olefinic compound;
oxindoles;
pyrroles		angiogenesis modulating agent;
antineoplastic agent;
EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor;
vascular endothelial growth factor receptor antagonist
orantinib[no description available]medium10
(6E)-7-[3-(4-fluorophenyl)-1-(propan-2-yl)-1H-indol-2-yl]-3,5-dihydroxyhept-6-enoic acid[no description available]medium10dihydroxy monocarboxylic acid;
indoles;
organofluorine compound
molsidomine[no description available]medium10ethyl ester;
morpholines;
oxadiazole;
zwitterion		antioxidant;
apoptosis inhibitor;
cardioprotective agent;
nitric oxide donor;
vasodilator agent
naltrexone[no description available]high20cyclopropanes;
morphinane-like compound;
organic heteropentacyclic compound		antidote to opioid poisoning;
central nervous system depressant;
environmental contaminant;
mu-opioid receptor antagonist;
xenobiotic
dextromethorphan[no description available]medium106-methoxy-11-methyl-1,3,4,9,10,10a-hexahydro-2H-10,4a-(epiminoethano)phenanthreneantitussive;
environmental contaminant;
neurotoxin;
NMDA receptor antagonist;
oneirogen;
prodrug;
xenobiotic
lisinopril[no description available]medium10dipeptideEC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor
indinavir sulfate[no description available]medium10dicarboxylic acid diamide;
N-(2-hydroxyethyl)piperazine;
piperazinecarboxamide		HIV protease inhibitor
bleomycin[no description available]medium10bleomycinantineoplastic agent;
metabolite
enalaprilat anhydrous[no description available]medium10dicarboxylic acid;
dipeptide		antihypertensive agent;
EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor
imidapril[no description available]medium10dicarboxylic acid monoester;
dipeptide;
ethyl ester;
imidazolidines;
N-acylurea;
secondary amino compound		antihypertensive agent;
EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor;
prodrug
sulindac sulfone[no description available]medium10monocarboxylic acid;
organofluorine compound;
sulfone		apoptosis inducer;
cyclooxygenase 2 inhibitor;
EC 1.13.11.34 (arachidonate 5-lipoxygenase) inhibitor
ximelagatran[no description available]medium10amidoxime;
azetidines;
carboxamide;
ethyl ester;
hydroxylamines;
secondary amino compound;
secondary carboxamide;
tertiary carboxamide		anticoagulant;
EC 3.4.21.5 (thrombin) inhibitor;
prodrug;
serine protease inhibitor
trandolapril[no description available]medium10dicarboxylic acid monoester;
dipeptide;
ethyl ester;
organic heterobicyclic compound;
secondary amino compound;
tertiary carboxamide		antihypertensive agent;
EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor;
prodrug
guanabenz acetate[no description available]medium10dichlorobenzenegeroprotector
famotidine[no description available]medium101,3-thiazoles;
guanidines;
sulfonamide		anti-ulcer drug;
H2-receptor antagonist;
P450 inhibitor
cefotaxime[no description available]medium101,3-thiazoles;
cephalosporin;
oxime O-ether		antibacterial drug;
drug allergen
aztreonam[no description available]medium10beta-lactam antibiotic allergen;
monobactam		antibacterial drug;
drug allergen;
EC 2.4.1.129 (peptidoglycan glycosyltransferase) inhibitor
proguanil[no description available]medium10biguanides;
monochlorobenzenes		antimalarial;
antiprotozoal drug;
EC 1.5.1.3 (dihydrofolate reductase) inhibitor
rifamycin sv[no description available]medium10acetate ester;
cyclic ketal;
lactam;
macrocycle;
organic heterotetracyclic compound;
polyphenol;
rifamycins		antimicrobial agent;
antitubercular agent;
bacterial metabolite
epoprostenol sodium[no description available]medium10prostanoid
ixabepilone[no description available]medium101,3-thiazoles;
beta-hydroxy ketone;
epoxide;
lactam;
macrocycle		antineoplastic agent;
microtubule-destabilising agent
azlocillin[no description available]medium10penicillin allergen;
penicillin;
semisynthetic derivative		antibacterial drug
dantrolene sodium[no description available]medium10
nifurtimox[no description available]medium10nitrofuran antibiotic
roxithromycin[no description available]medium10roxithromycinenvironmental contaminant;
xenobiotic
beraprost[no description available]medium10enyne;
monocarboxylic acid;
organic heterotricyclic compound;
secondary alcohol;
secondary allylic alcohol		anti-inflammatory agent;
antihypertensive agent;
platelet aggregation inhibitor;
prostaglandin receptor agonist;
vasodilator agent
lanreotide[no description available]medium10
lu 208075[no description available]medium10diarylmethane
acetylcarnitine[no description available]medium10O-acetylcarnitine;
saturated fatty acyl-L-carnitine		human metabolite;
Saccharomyces cerevisiae metabolite
nifurtoinol[no description available]medium10hydrazone;
imidazolidine-2,4-dione;
nitrofuran antibiotic;
organonitrogen heterocyclic antibiotic		antibacterial drug;
antiinfective agent;
hepatotoxic agent
fosinopril[no description available]medium10
eflucimibe[no description available]medium10
etomoxir[no description available]medium10aromatic ether
pentagastrin[no description available]medium20organic molecular entity
azd 6244[no description available]medium10benzimidazoles;
bromobenzenes;
hydroxamic acid ester;
monochlorobenzenes;
organofluorine compound;
secondary amino compound		anticoronaviral agent;
antineoplastic agent;
EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor
vinflunine[no description available]medium10acetate ester;
methyl ester;
organic heteropentacyclic compound;
organic heterotetracyclic compound;
semisynthetic derivative;
vinca alkaloid		antineoplastic agent
baci-im[no description available]medium10homodetic cyclic peptide;
polypeptide;
zwitterion		antibacterial agent;
antimicrobial agent
pf 03491390[no description available]medium10
amodiaquine hydrochloride[no description available]medium10
tannins[no description available]medium10tannin
mesna[no description available]medium10organosulfonic acid
cerivastatin sodium[no description available]medium10organic sodium salt;
statin (synthetic)
monensin[no description available]medium10
oxacillin sodium[no description available]medium10organic sodium salt
sodium diatrizoate[no description available]medium10organic sodium salt;
organoiodine compound		radioopaque medium
dicumarol[no description available]medium50hydroxycoumarinanticoagulant;
EC 1.6.5.2 [NAD(P)H dehydrogenase (quinone)] inhibitor;
Hsp90 inhibitor;
vitamin K antagonist
piroxicam[no description available]medium10benzothiazine;
monocarboxylic acid amide;
pyridines		analgesic;
antirheumatic drug;
cyclooxygenase 1 inhibitor;
EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
non-steroidal anti-inflammatory drug
acenocoumarol[no description available]medium20C-nitro compound;
hydroxycoumarin;
methyl ketone		anticoagulant;
EC 1.6.5.2 [NAD(P)H dehydrogenase (quinone)] inhibitor
mobic[no description available]medium101,3-thiazoles;
benzothiazine;
monocarboxylic acid amide		analgesic;
antirheumatic drug;
cyclooxygenase 2 inhibitor;
non-steroidal anti-inflammatory drug
warfarin[no description available]medium290benzenes;
hydroxycoumarin;
methyl ketone
warfarin[no description available]medium293benzenes;
hydroxycoumarin;
methyl ketone
phenprocoumon[no description available]medium10hydroxycoumarinanticoagulant;
EC 1.6.5.2 [NAD(P)H dehydrogenase (quinone)] inhibitor
rolitetracycline[no description available]medium10
lornoxicam[no description available]medium10heteroaryl hydroxy compound;
monocarboxylic acid amide;
organochlorine compound;
pyridines;
thienothiazine		antipyretic;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug
ajmaline[no description available]medium10
entecavir[no description available]medium102-aminopurines;
oxopurine;
primary alcohol;
secondary alcohol		antiviral drug;
EC 2.7.7.49 (RNA-directed DNA polymerase) inhibitor
inosine[no description available]medium10inosines;
purines D-ribonucleoside		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
folic acid[no description available]high20folic acids;
N-acyl-amino acid		human metabolite;
mouse metabolite;
nutrient
clozapine[no description available]high30benzodiazepine;
N-arylpiperazine;
N-methylpiperazine;
organochlorine compound		adrenergic antagonist;
dopaminergic antagonist;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
environmental contaminant;
GABA antagonist;
histamine antagonist;
muscarinic antagonist;
second generation antipsychotic;
serotonergic antagonist;
xenobiotic
didanosine[no description available]medium10purine 2',3'-dideoxyribonucleosideantimetabolite;
antiviral drug;
EC 2.4.2.1 (purine-nucleoside phosphorylase) inhibitor;
geroprotector;
HIV-1 reverse transcriptase inhibitor
sildenafil[no description available]medium10piperazines;
pyrazolopyrimidine;
sulfonamide		EC 3.1.4.35 (3',5'-cyclic-GMP phosphodiesterase) inhibitor;
vasodilator agent
olanzapine[no description available]medium10benzodiazepine;
N-arylpiperazine;
N-methylpiperazine		antiemetic;
dopaminergic antagonist;
histamine antagonist;
muscarinic antagonist;
second generation antipsychotic;
serotonergic antagonist;
serotonin uptake inhibitor
penciclovir[no description available]medium102-aminopurines;
propane-1,3-diols		antiviral drug
oxypurinol[no description available]medium10pyrazolopyrimidinedrug metabolite;
EC 1.17.3.2 (xanthine oxidase) inhibitor
raltitrexed[no description available]medium10N-acyl-amino acid
leucovorin[no description available]medium10formyltetrahydrofolic acidEscherichia coli metabolite;
mouse metabolite
tirapazamine[no description available]medium10aromatic amine;
benzotriazines;
N-oxide		antibacterial agent;
antineoplastic agent;
apoptosis inducer
rifabutin[no description available]medium10
chloroacetaldehyde[no description available]medium30organochlorine compound
3-hydroxybenzaldehyde[no description available]medium10hydroxybenzaldehyde
4-hydroxybenzaldehyde[no description available]medium10hydroxybenzaldehydeEC 1.14.17.1 (dopamine beta-monooxygenase) inhibitor;
mouse metabolite;
plant metabolite
acetaldehyde[no description available]high260aldehydecarcinogenic agent;
EC 3.5.1.4 (amidase) inhibitor;
electron acceptor;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
mutagen;
oxidising agent;
Saccharomyces cerevisiae metabolite;
teratogenic agent
benzaldehyde[no description available]medium10benzaldehydesEC 3.1.1.3 (triacylglycerol lipase) inhibitor;
EC 3.5.5.1 (nitrilase) inhibitor;
flavouring agent;
fragrance;
odorant receptor agonist;
plant metabolite
propionaldehyde[no description available]medium50alpha-CH2-containing aldehyde;
propanals		Escherichia coli metabolite
4-nitrobenzaldehyde[no description available]medium10benzaldehydes;
C-nitro compound
glycolaldehyde[no description available]medium10glycolaldehydesfundamental metabolite;
human metabolite
vanillin[no description available]medium10benzaldehydes;
monomethoxybenzene;
phenols		anti-inflammatory agent;
anticonvulsant;
antioxidant;
flavouring agent;
plant metabolite
glutaral[no description available]medium10dialdehydecross-linking reagent;
disinfectant;
fixative
isobutyraldehyde[no description available]medium102-methyl-branched fatty aldehyde;
propanals		Saccharomyces cerevisiae metabolite
2-chlorobenzaldehyde[no description available]medium10
salicylaldehyde[no description available]medium10hydroxybenzaldehydenematicide;
plant metabolite
furaldehyde[no description available]medium20aldehyde;
furans		Maillard reaction product;
metabolite
thiophene-2-carboxaldehyde[no description available]medium10aldehyde;
thiophenes		metabolite
3-nitrobenzaldehyde[no description available]medium10
4-(dimethylamino)benzaldehyde[no description available]medium10benzaldehydes;
substituted aniline;
tertiary amino compound		chromogenic compound
4-chlorobenzaldehyde[no description available]medium10
glyoxal[no description available]medium10dialdehydeagrochemical;
allergen;
pesticide;
plant growth regulator
2-Methoxybenzaldehyde[no description available]medium10carbonyl compound
protocatechualdehyde[no description available]medium10dihydroxybenzaldehyde
4-methylphenylhydrazine[no description available]medium10
malondialdehyde[no description available]medium30dialdehydebiomarker
2-nitrobenzaldehyde[no description available]medium10benzaldehydes;
C-nitro compound
4-aminobenzaldehyde[no description available]medium10benzaldehydes
isovanillin[no description available]medium10benzaldehydes;
monomethoxybenzene;
phenols		animal metabolite;
antidiarrhoeal drug;
antifungal agent;
EC 1.2.3.1 (aldehyde oxidase) inhibitor;
HIV protease inhibitor;
plant metabolite
4-anisaldehyde[no description available]medium10benzaldehydesbacterial metabolite;
human urinary metabolite;
insect repellent;
plant metabolite
2,5-dihydroxybenzaldehyde[no description available]medium10dihydroxybenzaldehydehuman metabolite;
mouse metabolite;
Penicillium metabolite
2-butenal[no description available]medium20enal
2,4-dinitrophenylhydrazine[no description available]medium10C-nitro compound;
phenylhydrazines		reagent
phthivazide[no description available]medium10
trichloroacetaldehyde[no description available]high880aldehyde;
organochlorine compound		mouse metabolite
trichloroacetaldehyde[no description available]high881aldehyde;
organochlorine compound		mouse metabolite
dexmedetomidine[no description available]medium3612medetomidinealpha-adrenergic agonist;
analgesic;
non-narcotic analgesic;
sedative
chlorine[no description available]medium300diatomic chlorine;
gas molecular entity		bleaching agent
chloroform[no description available]medium330chloromethanes;
one-carbon compound		carcinogenic agent;
central nervous system drug;
inhalation anaesthetic;
non-polar solvent;
refrigerant
bromide[no description available]medium180halide anion;
monoatomic bromine
xylazine[no description available]medium1601,3-thiazine;
methylbenzene;
secondary amino compound		alpha-adrenergic agonist;
analgesic;
emetic;
muscle relaxant;
sedative
tannins[no description available]medium20
lignin[no description available]medium20
sodium hypochlorite[no description available]medium10inorganic sodium saltbleaching agent;
disinfectant
triclofos[no description available]medium51monoalkyl phosphate
tetrodotoxin[no description available]medium60azatetracycloalkane;
oxatetracycloalkane;
quinazoline alkaloid		animal metabolite;
bacterial metabolite;
marine metabolite;
neurotoxin;
voltage-gated sodium channel blocker
2,2,2-trichloroethanol[no description available]medium550chloroethanolmouse metabolite
2,2,2-trichloroethanol[no description available]medium551chloroethanolmouse metabolite
phenyl acetate[no description available]medium260benzenes;
phenyl acetates
chloroacetic acid[no description available]medium50chlorocarboxylic acid;
haloacetic acid		alkylating agent;
herbicide
lorazepam[no description available]medium71benzodiazepine
ozone[no description available]medium50elemental molecule;
gas molecular entity;
reactive oxygen species;
triatomic oxygen		antiseptic drug;
disinfectant;
electrophilic reagent;
greenhouse gas;
mutagen;
oxidising agent;
tracer
bromates[no description available]medium30bromine oxoanion;
monovalent inorganic anion
melatonin[no description available]medium123acetamides;
tryptamines		anticonvulsant;
central nervous system depressant;
geroprotector;
hormone;
human metabolite;
immunological adjuvant;
mouse metabolite;
radical scavenger
tiletamine[no description available]medium10aralkylamine
zolazepam[no description available]medium10
methohexital[no description available]medium110acetylenic compound;
barbiturates		drug allergen;
intravenous anaesthetic
nocodazole[no description available]medium20aromatic ketone;
benzimidazoles;
carbamate ester;
thiophenes		antimitotic;
antineoplastic agent;
microtubule-destabilising agent;
tubulin modulator
esmolol[no description available]medium10aromatic ether;
ethanolamines;
methyl ester;
secondary alcohol;
secondary amino compound
hydroxyl radical[no description available]medium10oxygen hydride;
oxygen radical;
reactive oxygen species
nitrates[no description available]medium20monovalent inorganic anion;
nitrogen oxoanion;
reactive nitrogen species
nitrous oxide[no description available]medium623gas molecular entity;
nitrogen oxide		analgesic;
bacterial metabolite;
food packaging gas;
food propellant;
general anaesthetic;
greenhouse gas;
inhalation anaesthetic;
NMDA receptor antagonist;
raising agent;
refrigerant;
vasodilator agent
tribromoethanol[no description available]medium50alcohol;
organobromine compound
thiopental[no description available]medium330barbituratesanticonvulsant;
drug allergen;
environmental contaminant;
intravenous anaesthetic;
sedative;
xenobiotic
ethylene chlorohydrin[no description available]medium641chloroethanolxenobiotic metabolite
platinum[no description available]medium10elemental platinum;
nickel group element atom;
platinum group metal atom
dichloroacetic acid[no description available]medium212monocarboxylic acid;
organochlorine compound		astringent;
marine metabolite
tyrosine[no description available]medium41amino acid zwitterion;
erythrose 4-phosphate/phosphoenolpyruvate family amino acid;
L-alpha-amino acid;
proteinogenic amino acid;
tyrosine		EC 1.3.1.43 (arogenate dehydrogenase) inhibitor;
fundamental metabolite;
micronutrient;
nutraceutical
acetone[no description available]medium41ketone body;
methyl ketone;
propanones;
volatile organic compound		EC 3.5.1.4 (amidase) inhibitor;
human metabolite;
polar aprotic solvent
maleylacetone[no description available]medium11
hematoxylin[no description available]medium30organic heterotetracyclic compound;
oxacycle;
polyphenol;
tertiary alcohol		histological dye;
plant metabolite
t-butyloxycarbonyl-methionyl-leucyl-phenylalanine[no description available]medium10
ethane[no description available]medium10alkane;
gas molecular entity		plant metabolite;
refrigerant
1,1,1,2-tetrachloroethane[no description available]medium10chloroethanes
iodoacetic acid[no description available]medium10haloacetic acid;
organoiodine compound		alkylating agent
chlorodibromomethane[no description available]medium20organochlorine compound
2,3,4,6-tetrachlorophenol[no description available]medium20tetrachlorophenolxenobiotic metabolite
2,2-dichloroacetamide[no description available]medium10
4-hydroxybenzoic acid[no description available]medium10monohydroxybenzoic acidalgal metabolite;
plant metabolite
propylparaben[no description available]medium10benzoate ester;
paraben;
phenols		antifungal agent;
antimicrobial agent
kainic acid[no description available]medium40dicarboxylic acid;
L-proline derivative;
non-proteinogenic L-alpha-amino acid;
pyrrolidinecarboxylic acid		antinematodal drug;
excitatory amino acid agonist
trihexyphenidyl[no description available]medium30amine
cellulose[no description available]medium70glycoside
chloramine[no description available]medium30halide
daidzin[no description available]medium207-hydroxyisoflavones 7-O-beta-D-glucoside;
hydroxyisoflavone;
monosaccharide derivative		plant metabolite
bromine[no description available]medium30diatomic bromine
propoxycaine[no description available]medium10benzoate ester
proxymetacaine[no description available]medium10benzoate ester
2,4-diaminotoluene[no description available]medium10aminotoluenemetabolite
2,6-diaminotoluene[no description available]medium10diamine;
primary amino compound		mutagen
n-methyl-3,4-methylenedioxyamphetamine[no description available]medium20amphetamines;
benzodioxoles		neurotoxin
quetiapine fumarate[no description available]medium10fumarate salt
oxycodone[no description available]medium10organic heteropentacyclic compound;
semisynthetic derivative		antitussive;
mu-opioid receptor agonist;
opioid analgesic
ethyl glucuronide[no description available]medium10beta-D-glucosiduronic acidhuman urinary metabolite
glyceryl 1,2-dinitrate[no description available]medium10dinitroglycerol;
primary alcohol
hydrazine[no description available]medium70azane;
hydrazines		EC 4.3.1.10 (serine-sulfate ammonia-lyase) inhibitor
1,1-diethyl-2-hydroxy-2-nitrosohydrazine[no description available]medium10organic anion
chloralose[no description available]medium170
methylene blue[no description available]medium30organic chloride saltacid-base indicator;
antidepressant;
antimalarial;
antimicrobial agent;
antioxidant;
cardioprotective agent;
EC 1.4.3.4 (monoamine oxidase) inhibitor;
EC 3.1.1.8 (cholinesterase) inhibitor;
EC 4.6.1.2 (guanylate cyclase) inhibitor;
fluorochrome;
histological dye;
neuroprotective agent;
physical tracer
methylcellulose[no description available]medium10
deoxyglucose[no description available]medium50
iofetamine[no description available]medium10
chloropent[no description available]medium190
magnesium sulfate[no description available]medium470magnesium salt;
metal sulfate;
organic magnesium salt		anaesthetic;
analgesic;
anti-arrhythmia drug;
anticonvulsant;
calcium channel blocker;
cardiovascular drug;
fertilizer;
tocolytic agent
c(alpha)-formylglycine[no description available]medium103-oxoalanine;
amino acid zwitterion;
L-alanine derivative;
non-proteinogenic L-alpha-amino acid		Escherichia coli metabolite
1,1,1-trichloroacetone[no description available]medium10
alanine[no description available]medium20alanine zwitterion;
alanine;
L-alpha-amino acid;
proteinogenic amino acid;
pyruvate family amino acid		EC 4.3.1.15 (diaminopropionate ammonia-lyase) inhibitor;
fundamental metabolite
quinolinic acid[no description available]medium10pyridinedicarboxylic acidEscherichia coli metabolite;
human metabolite;
mouse metabolite;
NMDA receptor agonist
antipyrine[no description available]medium5610pyrazoloneantipyretic;
cyclooxygenase 3 inhibitor;
environmental contaminant;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
xenobiotic
midrin[no description available]medium111
atracurium[no description available]medium10diester;
quaternary ammonium ion		muscle relaxant;
nicotinic antagonist
chloropicrin[no description available]medium30C-nitro compound;
one-carbon compound;
organochlorine compound		antifungal agrochemical;
fumigant insecticide;
nematicide
glucose, (beta-d)-isomer[no description available]medium20D-glucopyranoseepitope;
mouse metabolite
galactosamine[no description available]medium10D-galactosamine;
primary amino compound		toxin
deuterium[no description available]medium20dihydrogen
deuterium oxide[no description available]medium10deuterated compound;
water		NMR solvent
hydrogen[no description available]medium80elemental hydrogen;
elemental molecule;
gas molecular entity		antioxidant;
electron donor;
food packaging gas;
fuel;
human metabolite
potassium bromate[no description available]medium10bromate salt;
potassium salt		flour treatment agent
chloroacetonitrile[no description available]medium10nitrile
dibromoacetonitrile[no description available]medium20aliphatic nitrile
nitrites[no description available]medium40monovalent inorganic anion;
nitrogen oxoanion;
reactive nitrogen species		human metabolite
dichloroacetaldehyde[no description available]medium20organochlorine compound
ethyl acetate[no description available]medium10acetate ester;
ethyl ester;
volatile organic compound		EC 3.4.19.3 (pyroglutamyl-peptidase I) inhibitor;
metabolite;
polar aprotic solvent;
Saccharomyces cerevisiae metabolite
n-methylaspartate[no description available]medium20amino dicarboxylic acid;
D-alpha-amino acid;
D-aspartic acid derivative;
secondary amino compound		neurotransmitter agent
gaboxadol[no description available]medium10oxazole
isoxazoles[no description available]medium10isoxazoles;
mancude organic heteromonocyclic parent;
monocyclic heteroarene
trifluoroacetaldehyde hydrate[no description available]medium20
3-chloro-4-(dichloromethyl)-5-hydroxy-2(5h)-furanone[no description available]medium30butenolide
lysine[no description available]medium10aspartate family amino acid;
L-alpha-amino acid zwitterion;
L-alpha-amino acid;
lysine;
organic molecular entity;
proteinogenic amino acid		algal metabolite;
anticonvulsant;
Escherichia coli metabolite;
human metabolite;
micronutrient;
mouse metabolite;
nutraceutical;
plant metabolite;
Saccharomyces cerevisiae metabolite
4-butyrolactone[no description available]medium60butan-4-olidemetabolite;
neurotoxin
calpain[no description available]medium10
4-hydroxy-2-nonenal[no description available]medium104-hydroxynon-2-enal;
4-hydroxynonenal
phosphorus radioisotopes[no description available]medium20
fluoranthene[no description available]medium10ortho- and peri-fused polycyclic arene
triphenyltin[no description available]medium10
diphenyl[no description available]medium10aromatic fungicide;
benzenes;
biphenyls		antifungal agrochemical;
antimicrobial food preservative
phoxim[no description available]medium10
atrazine[no description available]medium10chloro-1,3,5-triazine;
diamino-1,3,5-triazine		environmental contaminant;
herbicide;
xenobiotic
naphthalene[no description available]medium10naphthalenes;
ortho-fused bicyclic arene		apoptosis inhibitor;
carcinogenic agent;
environmental contaminant;
mouse metabolite;
plant metabolite;
volatile oil component
2,4,5-trichlorophenol[no description available]medium10trichlorophenol
diatrizoate meglumine[no description available]medium20monocarboxylic acid anionradioopaque medium
8-epi-prostaglandin f2alpha[no description available]medium10F2-isoprostanebiomarker;
bronchoconstrictor agent;
vasoconstrictor agent
barbituric acid[no description available]medium60barbituratesallergen;
xenobiotic
ether[no description available]medium210ether;
volatile organic compound		inhalation anaesthetic;
non-polar solvent;
refrigerant
dichloralantipyrine[no description available]medium133
mephenesin[no description available]medium40aromatic ether;
glycerol ether
galactose[no description available]medium20
podophyllin[no description available]medium20
carbamates[no description available]medium70amino-acid anion
pentaerythritol[no description available]medium20primary alcohol;
tetrol		flame retardant;
laxative
scopolamine hydrobromide[no description available]medium190
nitrobenzene[no description available]medium10nitroarene;
nitrobenzenes
ethyl chloride[no description available]medium40chloroethanesantipruritic drug;
inhalation anaesthetic;
local anaesthetic
pentylenetetrazole[no description available]medium260organic heterobicyclic compound;
organonitrogen heterocyclic compound
dinitrochlorobenzene[no description available]medium10C-nitro compound;
monochlorobenzenes		allergen;
epitope;
sensitiser
chlorobutanol[no description available]medium50tertiary alcohol
neostigmine[no description available]medium40quaternary ammonium ionantidote to curare poisoning;
EC 3.1.1.7 (acetylcholinesterase) inhibitor
tetramethylammonium[no description available]medium10quaternary ammonium ion
promazine[no description available]medium122phenothiazines;
tertiary amine		antiemetic;
dopaminergic antagonist;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
H1-receptor antagonist;
muscarinic antagonist;
phenothiazine antipsychotic drug;
serotonergic antagonist
dihydroergotoxine[no description available]medium30
quinine[no description available]medium50cinchona alkaloidantimalarial;
muscle relaxant;
non-narcotic analgesic
papaverine[no description available]medium50benzylisoquinoline alkaloid;
dimethoxybenzene;
isoquinolines		antispasmodic drug;
vasodilator agent
hydroxyindoleacetic acid[no description available]medium90indole-3-acetic acidsdrug metabolite;
human metabolite;
mouse metabolite
indoleacetic acid[no description available]medium10indole-3-acetic acids;
monocarboxylic acid		auxin;
human metabolite;
mouse metabolite;
plant hormone;
plant metabolite
secobarbital[no description available]medium244barbituratesanaesthesia adjuvant;
GABA modulator;
sedative
ethchlorvynol[no description available]medium150
benactyzine[no description available]medium80diarylmethane
adiphenine[no description available]medium10diarylmethane
hydromorphone[no description available]medium10morphinane alkaloid;
organic heteropentacyclic compound		mu-opioid receptor agonist;
opioid analgesic
piperidines[no description available]medium110
nad[no description available]medium200organophosphate oxoanioncofactor;
human metabolite;
hydrogen acceptor;
Saccharomyces cerevisiae metabolite
norethandrolone[no description available]medium10corticosteroid hormone
bilirubin[no description available]medium40biladienes;
dicarboxylic acid		antioxidant;
human metabolite;
mouse metabolite
buniodyl[no description available]medium10cinnamic acids
phenothiazine[no description available]medium10phenothiazineferroptosis inhibitor;
plant metabolite;
radical scavenger
paraldehyde[no description available]medium412trioxanesedative
cyclopropane[no description available]medium10cycloalkane;
cyclopropanes		inhalation anaesthetic
ethylene[no description available]medium10alkene;
gas molecular entity		plant hormone;
refrigerant
thiazoles[no description available]medium1301,3-thiazoles;
mancude organic heteromonocyclic parent;
monocyclic heteroarene
carbromal[no description available]medium10N-acylurea
trimeprazine[no description available]medium31phenothiazines
hyaluronoglucosaminidase[no description available]medium10
guaifenesin[no description available]medium70methoxybenzenes
hydroxydione[no description available]medium5020-oxo steroid;
21-hydroxy steroid;
3-oxo-5beta-steroid;
primary alpha-hydroxy ketone		human xenobiotic metabolite
picrotoxin[no description available]medium60
strychnine[no description available]medium220monoterpenoid indole alkaloid;
organic heteroheptacyclic compound		avicide;
cholinergic antagonist;
glycine receptor antagonist;
neurotransmitter agent;
rodenticide
barium[no description available]medium30alkaline earth metal atom;
elemental barium
methoxamine[no description available]medium10amphetaminesalpha-adrenergic agonist;
antihypotensive agent
acepromazine[no description available]medium80aromatic ketone;
methyl ketone;
phenothiazines;
tertiary amino compound		phenothiazine antipsychotic drug
cardiovascular agents[no description available]medium30
heroin[no description available]medium51morphinane alkaloidmu-opioid receptor agonist;
opioid analgesic;
prodrug
ethionine[no description available]medium20S-ethylhomocysteineantimetabolite;
carcinogenic agent
trypan red[no description available]medium10
methocarbamol[no description available]medium10aromatic ether;
carbamate ester;
secondary alcohol
azacyclonol[no description available]medium10diarylmethane
galantamine[no description available]medium10benzazepine alkaloid fundamental parent;
benzazepine alkaloid;
organic heterotetracyclic compound;
tertiary amino compound		antidote to curare poisoning;
cholinergic drug;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
EC 3.1.1.8 (cholinesterase) inhibitor;
plant metabolite
quinuclidines[no description available]medium10quinuclidines;
saturated organic heterobicyclic parent
benzene[no description available]medium50aromatic annulene;
benzenes;
volatile organic compound		carcinogenic agent;
environmental contaminant;
non-polar solvent
acetanilide[no description available]medium20acetamides;
anilide		analgesic
salicylates[no description available]medium90monohydroxybenzoateplant metabolite
camphor, (+-)-isomer[no description available]medium40bornane monoterpenoid;
cyclic monoterpene ketone		plant metabolite
4-amino-3-phenylbutyric acid[no description available]medium10organonitrogen compound;
organooxygen compound
bemegride[no description available]medium30piperidones
gamma-aminobutyric acid[no description available]medium50amino acid zwitterion;
gamma-amino acid;
monocarboxylic acid		human metabolite;
neurotransmitter;
Saccharomyces cerevisiae metabolite;
signalling molecule
caprolactam[no description available]medium10caprolactamshuman blood serum metabolite
thiourea[no description available]medium70one-carbon compound;
thioureas;
ureas		antioxidant;
chromophore
d-aspartic acid[no description available]medium10aspartic acid;
D-alpha-amino acid		mouse metabolite
aspartic acid[no description available]medium10aspartate family amino acid;
aspartic acid;
L-alpha-amino acid;
proteinogenic amino acid		Escherichia coli metabolite;
mouse metabolite;
neurotransmitter
chlorprothixene[no description available]medium61chlorprothixene
acid phosphatase[no description available]medium30
5-methoxytryptamine[no description available]medium10aromatic ether;
primary amino compound;
tryptamines		5-hydroxytryptamine 2A receptor agonist;
5-hydroxytryptamine 2B receptor agonist;
5-hydroxytryptamine 2C receptor agonist;
antioxidant;
cardioprotective agent;
human metabolite;
mouse metabolite;
neuroprotective agent;
radiation protective agent;
serotonergic agonist
glycine amide[no description available]medium10amino acid amide;
glycine derivative
ammonium chloride[no description available]medium10ammonium salt;
inorganic chloride		ferroptosis inhibitor
phensuximide[no description available]medium10pyrrolidines
methsuximide[no description available]medium10organic molecular entity
dextromoramide[no description available]medium20morpholines;
N-acylpyrrolidine		opioid analgesic
glycogen[no description available]medium60
dimenhydrinate[no description available]medium10diarylmethane
potassium iodide[no description available]medium20potassium saltexpectorant;
radical scavenger
thiophenes[no description available]medium10mancude organic heteromonocyclic parent;
monocyclic heteroarene;
thiophenes;
volatile organic compound		non-polar solvent
carmine[no description available]medium10
agar[no description available]medium10
sodium bromide[no description available]medium10bromide salt;
inorganic sodium salt
1,1,1-trichloroethane[no description available]medium30chloroethanespolar solvent
alprazolam[no description available]high41organochlorine compound;
triazolobenzodiazepine		anticonvulsant;
anxiolytic drug;
GABA agonist;
muscle relaxant;
sedative;
xenobiotic
morphinans[no description available]medium40isoquinoline alkaloid fundamental parent;
morphinane alkaloid
xylamine[no description available]medium10
pyrrolidine-2,4-dicarboxylic acid[no description available]medium10
xanthenes[no description available]medium10xanthene
chlorates[no description available]medium10chlorine oxoanion;
monovalent inorganic anion
arsenic[no description available]medium40metalloid atom;
pnictogen		micronutrient
serine[no description available]medium10L-alpha-amino acid;
proteinogenic amino acid;
serine family amino acid;
serine zwitterion;
serine		algal metabolite;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
chlorodiphenyl (54% chlorine)[no description available]medium10
buprenorphine[no description available]medium20morphinane alkaloiddelta-opioid receptor antagonist;
kappa-opioid receptor antagonist;
mu-opioid receptor agonist;
opioid analgesic
nomifensine[no description available]medium20isoquinolinesdopamine uptake inhibitor
cadmium[no description available]medium190cadmium molecular entity;
zinc group element atom
oligonucleotides[no description available]medium10
dimethyl phosphate[no description available]medium10dialkyl phosphate
dichlorvos[no description available]medium10alkenyl phosphate;
dialkyl phosphate;
organochlorine acaricide;
organophosphate insecticide		anthelminthic drug;
antibacterial agent;
antifungal agent;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
EC 3.1.1.8 (cholinesterase) inhibitor
bradykinin[no description available]medium30oligopeptidehuman blood serum metabolite;
vasodilator agent
s-(1,2-dichlorovinyl)cysteine[no description available]medium20S-(1,2-dichlorovinyl)-L-cysteine
cysteine[no description available]medium30cysteiniumfundamental metabolite
triazolam[no description available]medium52triazolobenzodiazepinesedative
formic acid[no description available]medium10monocarboxylic acidantibacterial agent;
astringent;
metabolite;
protic solvent;
solvent
flurothyl[no description available]medium10ether
cyclic gmp[no description available]medium203',5'-cyclic purine nucleotide;
guanyl ribonucleotide		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
plant metabolite;
Saccharomyces cerevisiae metabolite
cyanamide[no description available]medium30nitrile;
one-carbon compound		EC 1.2.1.3 [aldehyde dehydrogenase (NAD(+))] inhibitor
1,3-dipropyl-8-cyclopentylxanthine[no description available]medium10oxopurineadenosine A1 receptor antagonist;
EC 3.1.4.* (phosphoric diester hydrolase) inhibitor
thioperamide[no description available]medium10primary aliphatic amine
ciproxifan[no description available]medium10aromatic ketone
trausabun[no description available]medium10anthracenes
flupenthixol[no description available]medium20thioxanthenes
morpholine[no description available]medium10morpholines;
saturated organic heteromonocyclic parent		NMR chemical shift reference compound
chlorobenzene[no description available]medium10monochlorobenzenessolvent
selenium[no description available]medium10chalcogen;
nonmetal atom		micronutrient
nickel[no description available]medium10metal allergen;
nickel group element atom		epitope;
micronutrient
chlorine[no description available]medium220halide anion;
monoatomic chlorine		cofactor;
Escherichia coli metabolite;
human metabolite
ethyl biscoumacetate[no description available]medium10hydroxycoumarin
mercury[no description available]medium40elemental mercury;
zinc group element atom		neurotoxin
dibenzylchlorethamine[no description available]medium20
glycosides[no description available]medium10
histamine[no description available]medium100aralkylamino compound;
imidazoles		human metabolite;
mouse metabolite;
neurotransmitter
dimaprit[no description available]medium10imidothiocarbamic ester
impromidine[no description available]medium10
sodium oxybate[no description available]medium40
lithium[no description available]medium40alkali metal atom
wy 26703[no description available]medium10
idazoxan[no description available]medium20benzodioxine;
imidazolines		alpha-adrenergic antagonist
5-hydroxytryptophan[no description available]medium40hydroxytryptophanhuman metabolite;
neurotransmitter
3,4-dihydroxyphenylacetic acid[no description available]medium130catechols;
dihydroxyphenylacetic acid		human metabolite
homovanillic acid[no description available]medium90guaiacols;
monocarboxylic acid		human metabolite;
mouse metabolite
mercuric chloride[no description available]medium10mercury coordination entitysensitiser
lead[no description available]medium20carbon group element atom;
elemental lead;
metal atom		neurotoxin
arsenic trioxide[no description available]medium10
potassium cyanide[no description available]medium10cyanide salt;
one-carbon compound;
potassium salt		EC 1.15.1.1 (superoxide dismutase) inhibitor;
EC 1.9.3.1 (cytochrome c oxidase) inhibitor;
neurotoxin
sodium dodecyl sulfate[no description available]medium30organic sodium saltdetergent;
protein denaturant
vitamin k semiquinone radical[no description available]medium71
putrescine[no description available]medium30alkane-alpha,omega-diamineantioxidant;
fundamental metabolite
3-hydroxybenzylhydrazine[no description available]medium10phenols
fenclonine[no description available]medium30phenylalanine derivative
pargyline[no description available]medium50aromatic amine
thiobarbituric acid[no description available]medium10barbituratesallergen;
reagent
t 61[no description available]medium20
carbon monoxide[no description available]medium90carbon oxide;
gas molecular entity;
one-carbon compound		biomarker;
EC 1.9.3.1 (cytochrome c oxidase) inhibitor;
human metabolite;
ligand;
metabolite;
mitochondrial respiratory-chain inhibitor;
mouse metabolite;
neurotoxin;
neurotransmitter;
P450 inhibitor;
probe;
signalling molecule;
vasodilator agent
alphaprodine[no description available]medium20piperidines
thionicotinamide adenine dinucleotide[no description available]medium10
adenosine diphosphate ribose[no description available]medium10ADP-sugarEscherichia coli metabolite;
mouse metabolite
3-mercaptopropionic acid[no description available]medium10mercaptopropanoic acidalgal metabolite
pergolide[no description available]medium20diamine;
methyl sulfide;
organic heterotetracyclic compound		antiparkinson drug;
dopamine agonist
lysergic acid diethylamide[no description available]medium40ergoline alkaloid;
monocarboxylic acid amide;
organic heterotetracyclic compound		dopamine agonist;
hallucinogen;
serotonergic agonist
ergoline[no description available]medium40diamine;
ergoline alkaloid;
indole alkaloid fundamental parent;
indole alkaloid;
organic heterotetracyclic compound
methadyl acetate[no description available]medium10diarylmethane
clomipramine[no description available]medium20dibenzoazepineanticoronaviral agent;
antidepressant;
EC 1.8.1.12 (trypanothione-disulfide reductase) inhibitor;
serotonergic antagonist;
serotonergic drug;
serotonin uptake inhibitor
1,2,3,4-tetrahydroisoquinoline[no description available]medium20isoquinolines
immobilon[no description available]medium10
methotrimeprazine[no description available]medium10phenothiazines;
tertiary amine		anticoronaviral agent;
cholinergic antagonist;
dopaminergic antagonist;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
non-narcotic analgesic;
phenothiazine antipsychotic drug;
serotonergic antagonist
etorphine[no description available]medium10
methane[no description available]medium90alkane;
gas molecular entity;
mononuclear parent hydride;
one-carbon compound		bacterial metabolite;
fossil fuel;
greenhouse gas
thiamylal[no description available]medium10barbiturates;
organosulfur compound		sedative
vitamin b 12[no description available]medium30
unithiol[no description available]medium10
chlotazol[no description available]medium80
pronarcon[no description available]medium10barbiturates
thiobutabarbital[no description available]medium20
nadp[no description available]medium130
iodoacetamide[no description available]medium10
practolol[no description available]medium10acetamides;
ethanolamines;
propanolamine;
secondary alcohol;
secondary amino compound		anti-arrhythmia drug;
beta-adrenergic antagonist
desoxycorticosterone[no description available]medium2020-oxo steroid;
21-hydroxy steroid;
3-oxo-Delta(4) steroid;
mineralocorticoid;
primary alpha-hydroxy ketone		human metabolite;
mouse metabolite
potassium chloride[no description available]medium80inorganic chloride;
inorganic potassium salt;
potassium salt		fertilizer
methanol[no description available]medium70alkyl alcohol;
one-carbon compound;
primary alcohol;
volatile organic compound		amphiprotic solvent;
Escherichia coli metabolite;
fuel;
human metabolite;
mouse metabolite;
Mycoplasma genitalium metabolite
1-propanol[no description available]medium70propan-1-ols;
short-chain primary fatty alcohol		metabolite;
protic solvent
azaperone[no description available]medium10aminopyridine;
aromatic ketone;
monofluorobenzenes;
N-alkylpiperazine;
N-arylpiperazine;
tertiary amino compound		antipsychotic agent;
dopaminergic antagonist
3-methylcholanthrene[no description available]medium30ortho- and peri-fused polycyclic arenearyl hydrocarbon receptor agonist;
carcinogenic agent
dibucaine[no description available]medium30aromatic ether;
monocarboxylic acid amide;
tertiary amino compound		topical anaesthetic
deoxyguanosine[no description available]medium10purine 2'-deoxyribonucleoside;
purines 2'-deoxy-D-ribonucleoside		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
quipazine[no description available]medium10piperazines;
pyridines
thimerosal[no description available]medium140alkylmercury compoundantifungal drug;
antiseptic drug;
disinfectant;
drug allergen
cadmium chloride[no description available]medium170cadmium coordination entity
potassium hydroxide[no description available]medium10alkali metal hydroxide
nitroarginine[no description available]medium10guanidines;
L-arginine derivative;
N-nitro compound;
non-proteinogenic L-alpha-amino acid
ng-nitroarginine methyl ester[no description available]medium20alpha-amino acid ester;
L-arginine derivative;
methyl ester;
N-nitro compound		EC 1.14.13.39 (nitric oxide synthase) inhibitor
benomyl[no description available]medium30aromatic amide;
benzimidazole fungicide;
benzimidazoles;
benzimidazolylcarbamate fungicide;
carbamate ester		acaricide;
anthelminthic drug;
antifungal agrochemical;
microtubule-destabilising agent;
tubulin modulator
muscimol[no description available]medium10alkaloid;
isoxazoles;
primary amino compound		fungal metabolite;
GABA agonist;
oneirogen;
psychotropic drug
2-amino-5-phosphonovalerate[no description available]medium10non-proteinogenic alpha-amino acidNMDA receptor antagonist
6-cyano-7-nitroquinoxaline-2,3-dione[no description available]medium10quinoxaline derivative
mafosfamide[no description available]medium20
p-chloromercuribenzoic acid[no description available]medium10chlorine molecular entity;
mercuribenzoic acid
isosorbide-2-mononitrate[no description available]medium10
mercaptoethanol[no description available]medium20alkanethiol;
primary alcohol		geroprotector
helium[no description available]medium10monoatomic helium;
noble gas atom;
s-block element atom		food packaging gas
fosfestrol[no description available]medium30aryl phosphate
clonazepam[no description available]medium201,4-benzodiazepinone;
monochlorobenzenes		anticonvulsant;
anxiolytic drug;
GABA modulator
sumatriptan[no description available]medium41sulfonamide;
tryptamines		serotonergic agonist;
vasoconstrictor agent
isometheptene[no description available]medium42secondary amino compound
1-methyl-3-isobutylxanthine[no description available]medium103-isobutyl-1-methylxanthine
bromodichloromethane[no description available]medium20halomethaneenvironmental contaminant;
reagent
enkephalin, leucine[no description available]medium10pentapeptide;
peptide zwitterion		analgesic;
delta-opioid receptor agonist;
human metabolite;
mu-opioid receptor agonist;
neurotransmitter;
rat metabolite
preproenkephalin[no description available]medium10
1-butanol[no description available]medium50alkyl alcohol;
primary alcohol;
short-chain primary fatty alcohol		human metabolite;
mouse metabolite;
protic solvent
trichloroacetyl chloride[no description available]medium10
s-nitroso-n-acetylpenicillamine[no description available]medium10nitroso compound;
nitrosothio compound		nitric oxide donor;
vasodilator agent
pyrazole[no description available]medium20pyrazole
pirenzepine[no description available]medium10pyridobenzodiazepineanti-ulcer drug;
antispasmodic drug;
muscarinic antagonist
4-diphenylacetoxy-1,1-dimethylpiperidinium[no description available]medium10quaternary ammonium ioncholinergic antagonist;
muscarinic antagonist
(alpha-carboxycyclopropyl)glycine[no description available]medium10alpha-amino acid
alpha-methyl-4-carboxyphenylglycine[no description available]medium10non-proteinogenic alpha-amino acidmetabotropic glutamate receptor antagonist
dinitrobenzenes[no description available]medium10
5,7-dihydroxytryptamine[no description available]medium10
8-hydroxy-2-(di-n-propylamino)tetralin[no description available]medium20phenols;
tertiary amino compound;
tetralins		serotonergic antagonist
way 100135[no description available]medium10piperazines
o-chlorobenzylidenemalonitrile[no description available]medium10organochlorine compound
fucose[no description available]medium10fucopyranose;
L-fucose		Escherichia coli metabolite;
mouse metabolite
niaprazine[no description available]medium10piperazines
n(g)-nitroarginine-4-nitroanilide[no description available]medium10
gallamine triethiodide[no description available]medium10
succinylcholine[no description available]medium50quaternary ammonium ion;
succinate ester		drug allergen;
muscle relaxant;
neuromuscular agent
tubocurarine[no description available]medium40bisbenzylisoquinoline alkaloiddrug allergen;
muscle relaxant;
nicotinic antagonist
1-trichloromethyl-1,2,3,4-tetrahydro-beta-carboline[no description available]medium31
nicardipine[no description available]medium10benzenes;
C-nitro compound;
diester;
dihydropyridine;
methyl ester;
tertiary amino compound
glyoxylic acid[no description available]medium102-oxo monocarboxylic acid;
aldehydic acid		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
oxalic acid[no description available]medium10alpha,omega-dicarboxylic acidalgal metabolite;
human metabolite;
plant metabolite
oxalates[no description available]medium10
cystine[no description available]medium10
dizocilpine maleate[no description available]medium20maleate salt;
tetracyclic antidepressant		anaesthetic;
anticonvulsant;
neuroprotective agent;
nicotinic antagonist;
NMDA receptor antagonist
nitrophenols[no description available]medium50
u 78517f[no description available]medium10
citral[no description available]medium10enal;
monoterpenoid;
polyprenal		plant metabolite;
volatile oil component
pyruvaldehyde[no description available]medium102-oxo aldehyde;
propanals		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
aminooxyacetic acid[no description available]medium30amino acid;
hydroxylamines;
monocarboxylic acid		anticonvulsant;
EC 2.6.1.19 (4-aminobutyrate--2-oxoglutarate transaminase) inhibitor;
EC 4.2.1.22 (cystathionine beta-synthase) inhibitor;
nootropic agent
alpha-amino-3-hydroxy-5-methyl-4-isoxazolepropionic acid[no description available]medium10non-proteinogenic alpha-amino acid
tetradecanoylphorbol acetate[no description available]medium10acetate ester;
diester;
phorbol ester;
tertiary alpha-hydroxy ketone;
tetradecanoate ester		antineoplastic agent;
apoptosis inducer;
carcinogenic agent;
mitogen;
plant metabolite;
protein kinase C agonist;
reactive oxygen species generator
fluanisone[no description available]medium10aromatic ketone
gastrins[no description available]medium10
zaleplon[no description available]medium10nitrile;
pyrazolopyrimidine		anticonvulsant;
anxiolytic drug;
central nervous system depressant;
sedative
iodine[no description available]medium20halide anion;
monoatomic iodine		human metabolite
corticosterone[no description available]medium3011beta-hydroxy steroid;
20-oxo steroid;
21-hydroxy steroid;
3-oxo-Delta(4) steroid;
C21-steroid;
glucocorticoid;
primary alpha-hydroxy ketone		human metabolite;
mouse metabolite
ethyl methanesulfonate[no description available]medium10methanesulfonate esteralkylating agent;
antineoplastic agent;
carcinogenic agent;
genotoxin;
mutagen;
teratogenic agent
methyl methanesulfonate[no description available]medium20methanesulfonate esteralkylating agent;
apoptosis inducer;
carcinogenic agent;
genotoxin;
mutagen
lambertianic acid[no description available]medium10
proadifen[no description available]medium40diarylmethane
pyridine[no description available]medium10azaarene;
mancude organic heteromonocyclic parent;
monocyclic heteroarene;
pyridines		environmental contaminant;
NMR chemical shift reference compound
4-dimethylaminocinnamaldehyde[no description available]medium20cinnamaldehydes
flunarizine[no description available]medium20diarylmethane
oxidopamine[no description available]medium20benzenetriol;
catecholamine;
primary amino compound		drug metabolite;
human metabolite;
neurotoxin
pheniramine[no description available]medium10pyridines;
tertiary amino compound
cyanides[no description available]medium100pseudohalide anionEC 1.9.3.1 (cytochrome c oxidase) inhibitor
iberiotoxin[no description available]medium10
2-piperidone[no description available]medium70delta-lactam;
piperidones		EC 1.2.1.88 (L-glutamate gamma-semialdehyde dehydrogenase) inhibitor
flurazepam[no description available]high1021,4-benzodiazepinone;
monofluorobenzenes;
organochlorine compound;
tertiary amino compound		anticonvulsant;
anxiolytic drug;
GABAA receptor agonist;
sedative
phosphatidylcholines[no description available]medium201,2-diacyl-sn-glycero-3-phosphocholine
anisomycin[no description available]medium20monohydroxypyrrolidine;
organonitrogen heterocyclic antibiotic		anticoronaviral agent;
antimicrobial agent;
antineoplastic agent;
antiparasitic agent;
bacterial metabolite;
DNA synthesis inhibitor;
protein synthesis inhibitor
cobalt[no description available]medium20cobalt group element atom;
metal allergen		micronutrient
aluminum[no description available]medium10boron group element atom;
elemental aluminium;
metal atom
iodine[no description available]medium40diatomic iodinenutrient
egtazic acid[no description available]medium10diether;
tertiary amino compound;
tetracarboxylic acid		chelator
pindolol[no description available]medium30indoles;
secondary amine		antiglaucoma drug;
antihypertensive agent;
beta-adrenergic antagonist;
serotonergic antagonist;
vasodilator agent
ditiocarb[no description available]medium10dithiocarbamic acidschelator;
copper chelator
pyrogallol[no description available]medium10benzenetriol;
phenolic donor		plant metabolite
benserazide[no description available]medium20carbohydrazide;
catechols;
primary alcohol;
primary amino compound		antiparkinson drug;
dopaminergic agent;
EC 4.1.1.28 (aromatic-L-amino-acid decarboxylase) inhibitor
4-nitrophenyl acetate[no description available]medium20C-nitro compound;
phenyl acetates
pyrophosphate[no description available]medium20diphosphate ion
adenosine diphosphate[no description available]medium20adenosine 5'-phosphate;
purine ribonucleoside 5'-diphosphate		fundamental metabolite;
human metabolite
quinazolines[no description available]medium20azaarene;
mancude organic heterobicyclic parent;
ortho-fused heteroarene;
quinazolines
dixyrazine[no description available]medium10phenothiazines
sodium fluoride[no description available]medium10fluoride saltmutagen
ninhydrin[no description available]medium10aromatic ketone;
beta-diketone;
indanones;
ketone hydrate		colour indicator;
human metabolite
pyrimidinones[no description available]medium10
levorphanol[no description available]medium10morphinane alkaloid
neutral red[no description available]medium10hydrochlorideacid-base indicator;
dye;
two-colour indicator
mebikar[no description available]medium10imidazolidinone
protoverin[no description available]medium10
alkenes[no description available]medium21
dodecanol[no description available]medium10dodecanol;
primary alcohol		bacterial metabolite;
cosmetic;
insect attractant;
insecticide;
pheromone;
plant metabolite
diuron[no description available]medium103-(3,4-substituted-phenyl)-1,1-dimethylurea;
dichlorobenzene		environmental contaminant;
mitochondrial respiratory-chain inhibitor;
photosystem-II inhibitor;
urea herbicide;
xenobiotic
choline[no description available]medium50cholinesallergen;
Daphnia magna metabolite;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
neurotransmitter;
nutrient;
plant metabolite;
Saccharomyces cerevisiae metabolite
oxotremorine[no description available]medium30N-alkylpyrrolidine
indigo carmine[no description available]medium10
arecoline[no description available]medium20enoate ester;
methyl ester;
pyridine alkaloid;
tetrahydropyridine		metabolite;
muscarinic agonist
phenylalanine[no description available]medium20amino acid zwitterion;
erythrose 4-phosphate/phosphoenolpyruvate family amino acid;
L-alpha-amino acid;
phenylalanine;
proteinogenic amino acid		algal metabolite;
EC 3.1.3.1 (alkaline phosphatase) inhibitor;
Escherichia coli metabolite;
human xenobiotic metabolite;
micronutrient;
mouse metabolite;
nutraceutical;
plant metabolite;
Saccharomyces cerevisiae metabolite
arabinose[no description available]medium10L-arabinoseEscherichia coli metabolite;
mouse metabolite
puromycin[no description available]medium20puromycinsantiinfective agent;
antimicrobial agent;
antineoplastic agent;
EC 3.4.11.14 (cytosol alanyl aminopeptidase) inhibitor;
EC 3.4.14.2 (dipeptidyl-peptidase II) inhibitor;
nucleoside antibiotic;
protein synthesis inhibitor
glyceraldehyde[no description available]medium20aldotriosefundamental metabolite
dimethylacetamide[no description available]medium10acetamides;
monocarboxylic acid amide		human metabolite
n-chlorosuccinimide[no description available]medium10dicarboximide;
pyrrolidinone
lithium chloride[no description available]medium10inorganic chloride;
lithium salt		antimanic drug;
geroprotector
triphenylphosphine[no description available]medium10benzenes;
tertiary phosphine		NMR chemical shift reference compound;
reducing agent
trifluoroethanol[no description available]medium10fluoroalcohol
sk&f-38393[no description available]medium10benzazepine;
catechols;
secondary amino compound
quinpirole[no description available]medium20pyrazoloquinolinedopamine agonist
racemetirosine[no description available]medium10
edetic acid[no description available]medium10ethylenediamine derivative;
polyamino carboxylic acid;
tetracarboxylic acid		anticoagulant;
antidote;
chelator;
copper chelator;
geroprotector
veratridine[no description available]medium10
dichloroacetonitrile[no description available]medium10aliphatic nitrile
dicyclohexylcarbodiimide[no description available]medium10carbodiimideATP synthase inhibitor;
cross-linking reagent;
peptide coupling reagent
glycine ethyl ester[no description available]medium10
toluene[no description available]medium30methylbenzene;
toluenes;
volatile organic compound		cholinergic antagonist;
fuel additive;
neurotoxin;
non-polar solvent
benzyl alcohol[no description available]medium10benzyl alcoholsantioxidant;
fragrance;
metabolite;
solvent
neuropeptide y[no description available]medium10
retinaldehyde[no description available]medium10retinal;
vitamin A		gap junctional intercellular communication inhibitor;
human metabolite;
mouse metabolite
carboxyphosphamide[no description available]medium10nitrogen mustard
silver[no description available]medium20copper group element atom;
elemental silver		Escherichia coli metabolite
glucuronic acid[no description available]medium10D-glucuronic acidalgal metabolite
bromazepam[no description available]medium11organic molecular entity
3,4-methylenedioxyamphetamine[no description available]medium10benzodioxoles
2-(5-nitro-2-pyridylazo)-5-(n-propyl-n-sulfopropylamino)phenol[no description available]medium10
nikethamide[no description available]medium50pyridinecarboxamide
fructose 2,6-diphosphate[no description available]medium10D-fructofuranose 2,6-bisphosphatehuman metabolite;
mouse metabolite
mecamylamine[no description available]medium30primary aliphatic amine
1-methyl-beta-carboline-3-carboxylic acid[no description available]medium10
2-deoxyglucose-6-phosphate[no description available]medium10deoxyaldohexose phosphateEscherichia coli metabolite;
Mycoplasma genitalium metabolite
nalbuphine[no description available]medium10organic heteropentacyclic compoundmu-opioid receptor antagonist;
opioid analgesic
etimizol[no description available]medium10
dihydroxyphenylalanine[no description available]medium30hydroxyphenylalanine;
non-proteinogenic alpha-amino acid;
tyrosine derivative		human metabolite
guanidine[no description available]medium10carboxamidine;
guanidines;
one-carbon compound
saxitoxin[no description available]medium10alkaloid;
carbamate ester;
guanidines;
ketone hydrate;
paralytic shellfish toxin;
pyrrolopurine		cyanotoxin;
marine metabolite;
neurotoxin;
sodium channel blocker;
toxin
methylguanidine[no description available]medium10guanidinesEC 1.14.13.39 (nitric oxide synthase) inhibitor;
metabolite;
uremic toxin
gonyautoxin v[no description available]medium10organic heterotricyclic compound;
paralytic shellfish toxin		marine metabolite
carticaine[no description available]medium10thiophenecarboxylic acid
luminol[no description available]medium10
sincalide[no description available]medium10oligopeptide
diazinon[no description available]medium10organic thiophosphate;
pyrimidines		acaricide;
agrochemical;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
EC 3.1.1.8 (cholinesterase) inhibitor;
environmental contaminant;
nematicide;
xenobiotic
3-ketolithocholic acid[no description available]medium10oxo-5beta-cholanic acid
lithocholic acid[no description available]medium10bile acid;
C24-steroid;
monohydroxy-5beta-cholanic acid		geroprotector;
human metabolite;
mouse metabolite
phencyclidine[no description available]medium20benzenes;
piperidines		anaesthetic;
neurotoxin;
NMDA receptor antagonist;
psychotropic drug
cathinone[no description available]medium102-aminopropiophenone;
monoamine alkaloid		central nervous system stimulant;
psychotropic drug
pyrrolidonecarboxylic acid[no description available]medium105-oxoproline;
L-proline derivative;
non-proteinogenic L-alpha-amino acid		algal metabolite
chlorisondamine[no description available]medium10isoindoles
methylatropine[no description available]medium10
atrial natriuretic factor[no description available]medium10polypeptide
ethylmaleimide[no description available]medium20maleimidesanticoronaviral agent;
EC 1.3.1.8 [acyl-CoA dehydrogenase (NADP(+))] inhibitor;
EC 2.1.1.122 [(S)-tetrahydroprotoberberine N-methyltransferase] inhibitor;
EC 2.7.1.1 (hexokinase) inhibitor
pyruvic acid[no description available]medium202-oxo monocarboxylic acidcofactor;
fundamental metabolite
carbon tetrachloride[no description available]medium50chlorocarbon;
chloromethanes		hepatotoxic agent;
refrigerant
sodium sulfite[no description available]medium10inorganic sodium salt;
sulfite salt		food preservative;
reducing agent
sulfites[no description available]medium30divalent inorganic anion;
sulfur oxide;
sulfur oxoanion
uric acid[no description available]medium10uric acidEscherichia coli metabolite;
human metabolite;
mouse metabolite
methylmercury hydroxide[no description available]medium10
ethidium[no description available]medium10phenanthridinesfluorochrome;
intercalator
2,2'-dipyridyl[no description available]medium10bipyridinechelator;
ferroptosis inhibitor
2,2'-dipyridyl disulfide[no description available]medium10organic disulfide;
pyridines		oxidising agent
3,4-dihydroxyphenylacetaldehyde[no description available]medium10alpha-CH2-containing aldehyde;
catechols;
phenylacetaldehydes		Escherichia coli metabolite;
human metabolite;
mouse metabolite
leucine[no description available]medium10amino acid zwitterion;
L-alpha-amino acid;
leucine;
proteinogenic amino acid;
pyruvate family amino acid		algal metabolite;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
plant metabolite;
Saccharomyces cerevisiae metabolite
cholecystokinin[no description available]medium10
malonic acid[no description available]medium10alpha,omega-dicarboxylic acidhuman metabolite
1h-tetrazole[no description available]medium10one-carbon compound;
tetrazole
2-nitrophenol[no description available]medium102-nitrophenols
1,2,4-triazole[no description available]medium101,2,4-triazole
triazoles[no description available]medium101,2,3-triazole
preclamol[no description available]medium10
chromates[no description available]medium10chromium oxoanion;
divalent inorganic anion		oxidising agent
erythrosine[no description available]medium10
copper gluconate[no description available]medium10organic molecular entity
alprenolol[no description available]medium20secondary alcohol;
secondary amino compound		anti-arrhythmia drug;
antihypertensive agent;
beta-adrenergic antagonist;
sympatholytic agent
hydrogen carbonate[no description available]medium40carbon oxoanioncofactor;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
tripelennamine[no description available]medium20aromatic amine
adenosine monophosphate[no description available]medium10adenosine 5'-phosphate;
purine ribonucleoside 5'-monophosphate		adenosine A1 receptor agonist;
cofactor;
EC 3.1.3.1 (alkaline phosphatase) inhibitor;
EC 3.1.3.11 (fructose-bisphosphatase) inhibitor;
fundamental metabolite;
micronutrient;
nutraceutical
fluorine[no description available]medium42diatomic fluorine;
gas molecular entity		NMR chemical shift reference compound
ammonium sulfate[no description available]medium10ammonium salt;
inorganic sulfate salt		fertilizer
phenindione[no description available]medium10aromatic ketone;
beta-diketone		anticoagulant
ouabain[no description available]medium2011alpha-hydroxy steroid;
14beta-hydroxy steroid;
5beta-hydroxy steroid;
alpha-L-rhamnoside;
cardenolide glycoside;
steroid hormone		anti-arrhythmia drug;
cardiotonic drug;
EC 2.3.3.1 [citrate (Si)-synthase] inhibitor;
EC 3.1.3.41 (4-nitrophenylphosphatase) inhibitor;
EC 3.6.3.10 (H(+)/K(+)-exchanging ATPase) inhibitor;
EC 3.6.3.9 (Na(+)/K(+)-transporting ATPase) inhibitor;
ion transport inhibitor;
plant metabolite
acetyl coenzyme a[no description available]medium10acyl-CoAacyl donor;
coenzyme;
effector;
fundamental metabolite
cortisone[no description available]medium1011-oxo steroid;
17alpha-hydroxy steroid;
20-oxo steroid;
21-hydroxy steroid;
3-oxo-Delta(4) steroid;
C21-steroid;
glucocorticoid;
primary alpha-hydroxy ketone;
tertiary alpha-hydroxy ketone		human metabolite;
mouse metabolite
flavin mononucleotide[no description available]medium10
coenzyme a[no description available]medium10adenosine 3',5'-bisphosphatecoenzyme;
Escherichia coli metabolite;
mouse metabolite
beta-aminoethyl isothiourea[no description available]medium10
cystamine[no description available]medium20organic disulfide;
primary amino compound		EC 2.3.2.13 (protein-glutamine gamma-glutamyltransferase) inhibitor
cysteamine[no description available]medium10amine;
thiol		geroprotector;
human metabolite;
mouse metabolite;
radiation protective agent
methionine sulfoximine[no description available]medium10methionine derivative;
non-proteinogenic alpha-amino acid;
sulfoximide
naphazoline[no description available]medium10naphthalenes
tolazoline[no description available]medium30imidazolesalpha-adrenergic antagonist;
antihypertensive agent;
vasodilator agent
dextrothyroxine[no description available]medium10D-tyrosine derivative;
thyroxine
glucagon[no description available]medium10peptide hormone
cholestyramine resin[no description available]medium10
fenfluramine[no description available]medium10(trifluoromethyl)benzenes;
secondary amino compound		appetite depressant;
serotonergic agonist;
serotonin uptake inhibitor
indocyanine green[no description available]medium101,1-diunsubstituted alkanesulfonate;
benzoindole;
cyanine dye
pentazocine[no description available]medium30benzazocine
pituitrin[no description available]medium10
methyl chloride[no description available]medium10chloromethanes;
methyl halides		marine metabolite;
mutagen;
refrigerant
trifluperidol[no description available]medium11aromatic ketone
manganese[no description available]medium10elemental manganese;
manganese group element atom		Escherichia coli metabolite;
micronutrient
n-pentanol[no description available]medium10pentanol;
short-chain primary fatty alcohol		human metabolite;
plant metabolite
sulfobromophthalein[no description available]medium102-benzofurans;
organobromine compound;
organosulfonic acid;
phenols		dye
flumethasone[no description available]medium1011beta-hydroxy steroid;
17alpha-hydroxy steroid;
20-oxo steroid;
21-hydroxy steroid;
3-oxo-Delta(1),Delta(4)-steroid;
fluorinated steroid;
glucocorticoid;
primary alpha-hydroxy ketone;
tertiary alpha-hydroxy ketone		anti-inflammatory drug
p-methoxy-n-methylphenethylamine[no description available]medium10aromatic ether;
secondary amino compound		metabolite
desipramine[no description available]medium30dibenzoazepine;
secondary amino compound		adrenergic uptake inhibitor;
alpha-adrenergic antagonist;
antidepressant;
cholinergic antagonist;
drug allergen;
EC 3.1.4.12 (sphingomyelin phosphodiesterase) inhibitor;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
H1-receptor antagonist;
serotonin uptake inhibitor
1-hexanol[no description available]medium10hexanol;
primary alcohol		alarm pheromone;
antibacterial agent;
fragrance;
plant metabolite
taurine[no description available]medium20amino sulfonic acid;
zwitterion		antioxidant;
Escherichia coli metabolite;
glycine receptor agonist;
human metabolite;
mouse metabolite;
nutrient;
radical scavenger;
Saccharomyces cerevisiae metabolite
echothiophate iodide[no description available]medium10iodide salt;
quaternary ammonium salt		antiglaucoma drug;
EC 3.1.1.8 (cholinesterase) inhibitor;
miotic
isoflurophate[no description available]medium10dialkyl phosphate
phenoperidine[no description available]medium10piperidines
levallorphan[no description available]medium10morphinane alkaloid
trifluoperazine[no description available]medium10N-alkylpiperazine;
N-methylpiperazine;
organofluorine compound;
phenothiazines		antiemetic;
calmodulin antagonist;
dopaminergic antagonist;
EC 1.8.1.12 (trypanothione-disulfide reductase) inhibitor;
EC 5.3.3.5 (cholestenol Delta-isomerase) inhibitor;
phenothiazine antipsychotic drug
acridines[no description available]medium10acridines;
mancude organic heterotricyclic parent;
polycyclic heteroarene		genotoxin
ornithine[no description available]medium10non-proteinogenic L-alpha-amino acid;
ornithine		algal metabolite;
hepatoprotective agent;
mouse metabolite
pteridines[no description available]medium10azaarene;
mancude organic heterobicyclic parent;
ortho-fused heteroarene;
pteridines
propanidid[no description available]medium10methoxybenzenes
phosphocreatine[no description available]medium20phosphagen;
phosphoamino acid		human metabolite;
mouse metabolite
benperidol[no description available]medium10aromatic ketone
17-ketosteroids[no description available]medium10
chlorophyll a[no description available]medium20chlorophyll;
methyl ester		cofactor
tremorine[no description available]medium10N-alkylpyrrolidine
iodopyracet[no description available]medium10
beta-escin[no description available]medium10
phloroglucinol[no description available]medium10benzenetriol;
phenolic donor		algal metabolite
tranylcypromine[no description available]medium102-phenylcyclopropan-1-amine
eye[no description available]medium11
inositol 3-phosphate[no description available]medium10
propiconazole[no description available]medium10conazole fungicide;
cyclic ketal;
dichlorobenzene;
triazole fungicide;
triazoles		antifungal agrochemical;
EC 1.14.13.70 (sterol 14alpha-demethylase) inhibitor;
environmental contaminant;
xenobiotic
phenylephrine hydrochloride[no description available]medium10hydrochloride
s,n,n'-tripropylthiocarbamate[no description available]medium20tertiary amine
exudates[no description available]medium20
apnea[no description available]medium40purine nucleoside
fomesafen[no description available]medium230aromatic ether;
C-nitro compound;
monochlorobenzenes;
N-sulfonylcarboxamide;
organofluorine compound;
phenols		agrochemical;
EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor;
herbicide
isomethyleugenol[no description available]medium40isomethyleugenol
humulene[no description available]medium30alpha-humulene
foxes[no description available]medium10
trazodone hydrochloride[no description available]medium20hydrochlorideadrenergic antagonist;
antidepressant;
H1-receptor antagonist;
sedative;
serotonin uptake inhibitor
sodium ethylxanthate[no description available]medium10
octane[no description available]low00alkanexenobiotic
2-nitropropane[no description available]low00secondary nitroalkanecarcinogenic agent;
hepatotoxic agent;
polar aprotic solvent;
xenobiotic
dibenzofuran[no description available]low00dibenzofurans;
mancude organic heterotricyclic parent;
polycyclic heteroarene		xenobiotic
1-(3-chlorophenyl)piperazine[no description available]low00monochlorobenzenes;
N-arylpiperazine		drug metabolite;
environmental contaminant;
serotonergic agonist;
xenobiotic
acetochlor[no description available]medium00aromatic amide;
monocarboxylic acid amide;
organochlorine compound		environmental contaminant;
herbicide;
xenobiotic
alachlor[no description available]medium00aromatic amide;
monocarboxylic acid amide;
organochlorine compound		environmental contaminant;
herbicide;
xenobiotic
diatrizoic acid[no description available]low00acetamides;
benzoic acids;
organoiodine compound		environmental contaminant;
radioopaque medium;
xenobiotic
dan 2163[no description available]low00aromatic amide;
aromatic amine;
benzamides;
pyrrolidines;
sulfone		environmental contaminant;
second generation antipsychotic;
xenobiotic
antazoline[no description available]low00aromatic amine;
imidazolines;
tertiary amino compound		cholinergic antagonist;
H1-receptor antagonist;
xenobiotic
bentazone[no description available]low00benzothiadiazineenvironmental contaminant;
herbicide;
xenobiotic
candesartan[no description available]low00benzimidazolecarboxylic acid;
biphenylyltetrazole		angiotensin receptor antagonist;
antihypertensive agent;
environmental contaminant;
xenobiotic
chlorpyrifos[no description available]low00chloropyridine;
organic thiophosphate		acaricide;
agrochemical;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
EC 3.1.1.8 (cholinesterase) inhibitor;
environmental contaminant;
insecticide;
xenobiotic
dichlobanil[no description available]low00dichlorobenzene;
nitrile		agrochemical;
cellulose synthesis inhibitor;
environmental contaminant;
herbicide;
xenobiotic
dimethoate[no description available]low00monocarboxylic acid amide;
organic thiophosphate		acaricide;
agrochemical;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
EC 3.1.1.8 (cholinesterase) inhibitor;
environmental contaminant;
insecticide;
xenobiotic
gabapentin[no description available]low00gamma-amino acidanticonvulsant;
calcium channel blocker;
environmental contaminant;
xenobiotic
iomeprol[no description available]low00benzenedicarboxamide;
organoiodine compound		environmental contaminant;
radioopaque medium;
xenobiotic
iopromide[no description available]low00dicarboxylic acid diamide;
organoiodine compound		environmental contaminant;
nephrotoxic agent;
radioopaque medium;
xenobiotic
tetramisole[no description available]low00imidazothiazoleenvironmental contaminant;
xenobiotic
methomyl[no description available]low00aliphatic sulfide;
carbamate ester		acaricide;
agrochemical;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
EC 3.1.1.8 (cholinesterase) inhibitor;
environmental contaminant;
insecticide;
nematicide;
xenobiotic
1-(3-trifluoromethylphenyl)piperazine[no description available]low00(trifluoromethyl)benzenes;
N-arylpiperazine		environmental contaminant;
psychotropic drug;
serotonergic agonist;
xenobiotic
pioglitazone[no description available]low00aromatic ether;
pyridines;
thiazolidinediones		antidepressant;
cardioprotective agent;
EC 2.7.1.33 (pantothenate kinase) inhibitor;
EC 6.2.1.3 (long-chain-fatty-acid--CoA ligase) inhibitor;
ferroptosis inhibitor;
geroprotector;
hypoglycemic agent;
insulin-sensitizing drug;
PPARgamma agonist;
xenobiotic
prometone[no description available]low00diamino-1,3,5-triazine;
methoxy-1,3,5-triazine		environmental contaminant;
herbicide;
xenobiotic
prometryne[no description available]low00diamino-1,3,5-triazine;
methylthio-1,3,5-triazine		environmental contaminant;
herbicide;
xenobiotic
propachlor[no description available]medium00anilide;
monocarboxylic acid amide;
organochlorine compound		environmental contaminant;
herbicide;
xenobiotic
propazine[no description available]low00chloro-1,3,5-triazine;
diamino-1,3,5-triazine		environmental contaminant;
herbicide;
xenobiotic
saccharin[no description available]low001,2-benzisothiazole;
N-sulfonylcarboxamide		environmental contaminant;
sweetening agent;
xenobiotic
simazine[no description available]low00chloro-1,3,5-triazine;
diamino-1,3,5-triazine		environmental contaminant;
herbicide;
xenobiotic
trifluralin[no description available]low00(trifluoromethyl)benzenes;
C-nitro compound;
substituted aniline		agrochemical;
environmental contaminant;
herbicide;
xenobiotic
trimipramine[no description available]low00dibenzoazepine;
tertiary amino compound		antidepressant;
environmental contaminant;
xenobiotic
bisphenol a[no description available]low00bisphenolendocrine disruptor;
environmental contaminant;
xenobiotic;
xenoestrogen
2-methyl-4-chlorophenoxy gamma-butyric acid[no description available]low00aromatic ether;
monocarboxylic acid;
monochlorobenzenes		environmental contaminant;
phenoxy herbicide;
xenobiotic
benzotriazole[no description available]low00benzotriazolesenvironmental contaminant;
xenobiotic
benzothiazole[no description available]low00benzothiazolesenvironmental contaminant;
plant metabolite;
xenobiotic
3,4-dichloroaniline[no description available]low00dichloroanilineepitope;
xenobiotic
acetophenone[no description available]low00acetophenonesanimal metabolite;
photosensitizing agent;
xenobiotic
triclocarban[no description available]low00dichlorobenzene;
monochlorobenzenes;
phenylureas		antimicrobial agent;
antiseptic drug;
disinfectant;
environmental contaminant;
xenobiotic
fenuron[no description available]low003-(3,4-substituted-phenyl)-1,1-dimethylureaagrochemical;
environmental contaminant;
herbicide;
photosystem-II inhibitor;
xenobiotic
cyanuric acid[no description available]low001,3,5-triazinanes;
1,3,5-triazines;
heteroaryl hydroxy compound		xenobiotic
diglyme[no description available]low00polyetherenvironmental contaminant;
solvent;
xenobiotic
propylene[no description available]low00alkene;
gas molecular entity		refrigerant;
xenobiotic
2-naphthalenesulfonic acid[no description available]low00naphthalenesulfonic acidenvironmental contaminant;
xenobiotic
4-sulfanilic acid[no description available]low00aminobenzenesulfonic acidallergen;
environmental contaminant;
xenobiotic metabolite;
xenobiotic
5-tolyltriazole[no description available]low00benzotriazolesenvironmental contaminant;
xenobiotic
perfluorooctanoic acid[no description available]low00fluoroalkanoic acidcarcinogenic agent;
endocrine disruptor;
environmental contaminant;
surfactant;
xenobiotic
perfluorodecanoic acid[no description available]low00fluoroalkanoic acidenvironmental contaminant;
xenobiotic
perfluorobutyric acid[no description available]low00fluoroalkanoic acidchromatographic reagent;
environmental contaminant;
xenobiotic
triphenylmethane[no description available]low00triarylmethaneenvironmental contaminant;
xenobiotic
3-methylquinoline[no description available]low00methylquinolinexenobiotic
terbutryne[no description available]low00diamino-1,3,5-triazine;
methylthio-1,3,5-triazine		environmental contaminant;
herbicide;
xenobiotic
metformin hydrochloride[no description available]low00hydrochlorideenvironmental contaminant;
hypoglycemic agent;
xenobiotic
pyrazon[no description available]medium00benzenes;
organochlorine compound;
primary amino compound;
pyridazinone		environmental contaminant;
herbicide;
xenobiotic
methiocarb[no description available]low00aryl sulfide;
carbamate ester;
methyl sulfide		acaricide;
agrochemical;
avicide;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
environmental contaminant;
insecticide;
molluscicide;
xenobiotic
lenacil[no description available]low00cyclopentapyrimidineagrochemical;
environmental contaminant;
herbicide;
xenobiotic
fluometuron[no description available]low00(trifluoromethyl)benzenes;
3-(3,4-substituted-phenyl)-1,1-dimethylurea		agrochemical;
environmental contaminant;
herbicide;
photosystem-II inhibitor;
xenobiotic
1,2-benzisothiazoline-3-one[no description available]low00organic heterobicyclic compound;
organonitrogen heterocyclic compound		disinfectant;
drug allergen;
environmental contaminant;
platelet aggregation inhibitor;
sensitiser;
xenobiotic
asulam[no description available]low00carbamate ester;
primary amino compound;
substituted aniline;
sulfonamide		agrochemical;
EC 2.5.1.15 (dihydropteroate synthase) inhibitor;
environmental contaminant;
herbicide;
xenobiotic
chlorpyrifos-methyl[no description available]low00chloropyridine;
organic thiophosphate		acaricide;
agrochemical;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
environmental contaminant;
insecticide;
xenobiotic
terbutylazine[no description available]low00chloro-1,3,5-triazine;
diamino-1,3,5-triazine		environmental contaminant;
herbicide;
xenobiotic
1-indanol[no description available]low00aromatic alcohol;
indanes;
secondary alcohol		xenobiotic
desmedipham[no description available]low00carbamate esteragrochemical;
environmental contaminant;
herbicide;
xenobiotic
phenmedipham[no description available]low00carbamate esterenvironmental contaminant;
herbicide;
xenobiotic
chlortoluron[no description available]low00monochlorobenzenes;
phenylureas		agrochemical;
environmental contaminant;
herbicide;
xenobiotic
methoxuron[no description available]low003-(3,4-substituted-phenyl)-1,1-dimethylurea;
monochlorobenzenes;
monomethoxybenzene		agrochemical;
environmental contaminant;
herbicide;
photosystem-II inhibitor;
plant growth regulator;
xenobiotic
neohesperidin dihydrochalcone[no description available]low00dihydrochalcones;
disaccharide derivative;
neohesperidoside		environmental contaminant;
plant metabolite;
sweetening agent;
xenobiotic
metribuzin[no description available]low001,2,4-triazines;
cyclic ketone;
organic sulfide		agrochemical;
environmental contaminant;
herbicide;
xenobiotic
cyanazine[no description available]low001,3,5-triazinylamino nitrile;
chloro-1,3,5-triazine		environmental contaminant;
herbicide;
xenobiotic
pirimicarb[no description available]low00aminopyrimidine;
carbamate ester;
tertiary amino compound		agrochemical;
carbamate insecticide;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
environmental contaminant;
insecticide;
xenobiotic
propamocarb[no description available]low00carbamate ester;
carbamate fungicide;
tertiary amino compound		antifungal agrochemical;
environmental contaminant;
xenobiotic
5-chloro-2-methyl-4-isothiazolin-3-one[no description available]medium001,2-thiazoles;
organochlorine compound		antimicrobial agent;
environmental contaminant;
xenobiotic
2-n-octyl-4-isothiazolin-3-one[no description available]low001,2-thiazolesantibacterial agent;
antifungal agrochemical;
environmental contaminant;
xenobiotic
ioxitalamic acid[no description available]low00acetamides;
benzoic acids;
dicarboxylic acid monoamide;
organoiodine compound		environmental contaminant;
radioopaque medium;
xenobiotic
amitraz[no description available]low00formamidines;
tertiary amino compound		acaricide;
environmental contaminant;
insecticide;
xenobiotic
acetosulfame[no description available]low00organic heteromonocyclic compound;
organonitrogen heterocyclic compound;
oxacycle;
sulfamate ester		environmental contaminant;
sweetening agent;
xenobiotic
isoproturon[no description available]low003-(3,4-substituted-phenyl)-1,1-dimethylureaagrochemical;
environmental contaminant;
herbicide;
xenobiotic
metamitron[no description available]low001,2,4-triazinesenvironmental contaminant;
herbicide;
xenobiotic
triclopyr[no description available]low00aromatic ether;
chloropyridine;
monocarboxylic acid		agrochemical;
environmental contaminant;
herbicide;
xenobiotic
metazachlor[no description available]medium00aromatic amide;
organochlorine compound;
pyrazoles		environmental contaminant;
herbicide;
xenobiotic
4,5-amino-3,5-dichloro-6-fluoro-2-pyridinyloxyacetic acid[no description available]medium00aminopyridine;
aromatic ether;
monocarboxylic acid;
organochlorine compound;
organofluorine compound		environmental contaminant;
herbicide;
xenobiotic
fenoxycarb[no description available]low00aromatic ether;
carbamate ester		environmental contaminant;
insecticide;
juvenile hormone mimic;
xenobiotic
metsulfuron methyl[no description available]low001,3,5-triazines;
benzoate ester;
N-sulfonylurea		environmental contaminant;
herbicide;
xenobiotic
clomazone[no description available]low00isoxazolidinone;
monochlorobenzenes		agrochemical;
carotenoid biosynthesis inhibitor;
environmental contaminant;
herbicide;
xenobiotic
atomoxetine[no description available]low00aromatic ether;
secondary amino compound;
toluenes		adrenergic uptake inhibitor;
antidepressant;
environmental contaminant;
xenobiotic
aromasil[no description available]low0017-oxo steroid;
3-oxo-Delta(1),Delta(4)-steroid		antineoplastic agent;
EC 1.14.14.14 (aromatase) inhibitor;
environmental contaminant;
xenobiotic
gemcitabine[no description available]low00organofluorine compound;
pyrimidine 2'-deoxyribonucleoside		antimetabolite;
antineoplastic agent;
antiviral drug;
DNA synthesis inhibitor;
EC 1.17.4.1 (ribonucleoside-diphosphate reductase) inhibitor;
environmental contaminant;
immunosuppressive agent;
photosensitizing agent;
prodrug;
radiosensitizing agent;
xenobiotic
prosulfocarb[no description available]low00benzenes;
monothiocarbamic ester		environmental contaminant;
herbicide;
xenobiotic
3-iodo-2-propynylbutylcarbamate[no description available]low00acetylenic compound;
carbamate ester;
carbamate fungicide;
organoiodine compound		antifungal agrochemical;
environmental contaminant;
xenobiotic
oseltamivir[no description available]low00acetamides;
amino acid ester;
cyclohexenecarboxylate ester;
primary amino compound		antiviral drug;
EC 3.2.1.18 (exo-alpha-sialidase) inhibitor;
environmental contaminant;
prodrug;
xenobiotic
iopamidol[no description available]low00benzenedicarboxamide;
organoiodine compound;
pentol		environmental contaminant;
radioopaque medium;
xenobiotic
iobitridol[no description available]low00benzenedicarboxamide;
hexol;
organoiodine compound		environmental contaminant;
radioopaque medium;
xenobiotic
perfluorohexanoic acid[no description available]low00fluoroalkanoic acidenvironmental contaminant;
xenobiotic
perfluoro-n-heptanoic acid[no description available]low00fluoroalkanoic acidenvironmental contaminant;
xenobiotic
perfluoro-n-nonanoic acid[no description available]low00fluoroalkanoic acidpersistent organic pollutant;
surfactant;
xenobiotic
acamprosate[no description available]low00acetamides;
organosulfonic acid		environmental contaminant;
neurotransmitter agent;
xenobiotic
trichlorosucrose[no description available]medium00disaccharide derivative;
organochlorine compound		environmental contaminant;
sweetening agent;
xenobiotic
nicosulfuron[no description available]low00N-sulfonylurea;
pyridines;
pyrimidines		environmental contaminant;
herbicide;
xenobiotic
prochloraz[no description available]low00amide fungicide;
aromatic ether;
conazole fungicide;
imidazole fungicide;
imidazoles;
trichlorobenzene;
ureas		antifungal agrochemical;
EC 1.14.13.70 (sterol 14alpha-demethylase) inhibitor;
environmental contaminant;
xenobiotic
thifensulfuron methyl[no description available]low001,3,5-triazines;
methyl ester;
N-sulfonylurea;
thiophenes		agrochemical;
environmental contaminant;
herbicide;
xenobiotic
flusilazole[no description available]low00conazole fungicide;
monofluorobenzenes;
organosilicon compound;
triazole fungicide;
triazoles		antifungal agrochemical;
EC 1.14.13.70 (sterol 14alpha-demethylase) inhibitor;
environmental contaminant;
xenobiotic
perfluoropentanoic acid[no description available]low00fluoroalkanoic acidenvironmental contaminant;
xenobiotic
1-benzylpiperazine[no description available]low00N-alkylpiperazineenvironmental contaminant;
psychotropic drug;
serotonergic agonist;
xenobiotic
perfluoroundecanoic acid[no description available]low00fluoroalkanoic acidenvironmental contaminant;
xenobiotic
sulfluramid[no description available]low00sulfonamideacaricide;
environmental contaminant;
insecticide;
xenobiotic
spiroxamine[no description available]low00dioxolane;
spiroketal;
tertiary amino compound		antifungal agrochemical;
environmental contaminant;
sterol biosynthesis inhibitor;
xenobiotic
difenoconazole[no description available]low00aromatic ether;
conazole fungicide;
cyclic ketal;
dioxolane;
triazole fungicide;
triazoles		antifungal agrochemical;
EC 1.14.13.70 (sterol 14alpha-demethylase) inhibitor;
environmental contaminant;
xenobiotic
dimethomorph[no description available]low00mixture;
morpholine fungicide		antifungal agrochemical;
environmental contaminant;
xenobiotic
cyprodinil[no description available]low00aminopyrimidine;
anilinopyrimidine fungicide;
cyclopropanes;
secondary amino compound		antifungal agrochemical;
aryl hydrocarbon receptor agonist;
environmental contaminant;
xenobiotic
imidacloprid[no description available]low00imidacloprid;
imidazolidines;
monochloropyridine		environmental contaminant;
genotoxin;
neonicotinoid insectide;
nicotinic acetylcholine receptor agonist;
xenobiotic
foe 5043[no description available]low00aromatic amide;
monofluorobenzenes;
thiadiazoles		environmental contaminant;
herbicide;
xenobiotic
irgarol 1051[no description available]low00aryl sulfide;
cyclopropanes;
diamino-1,3,5-triazine		antifouling biocide;
environmental contaminant;
xenobiotic
pyrimethanil[no description available]low00aminopyrimidine;
anilinopyrimidine fungicide;
secondary amino compound		antifungal agrochemical;
aryl hydrocarbon receptor agonist;
environmental contaminant;
xenobiotic
kathon 930[no description available]medium001,2-thiazoles;
organochlorine compound		environmental contaminant;
fungicide;
xenobiotic
fluazinam[no description available]low00(trifluoromethyl)benzenes;
aminopyridine;
C-nitro compound;
chloropyridine;
monochlorobenzenes;
secondary amino compound		allergen;
antifungal agrochemical;
apoptosis inducer;
environmental contaminant;
xenobiotic
teflubenzuron[no description available]low00dichlorobenzene;
difluorobenzene;
N-acylurea		environmental contaminant;
insecticide;
xenobiotic
diflufenican[no description available]low00(trifluoromethyl)benzenes;
aromatic ether;
pyridinecarboxamide		carotenoid biosynthesis inhibitor;
environmental contaminant;
herbicide;
xenobiotic
sulcotrione[no description available]low00aromatic ketone;
beta-triketone;
cyclohexanones;
sulfone		carotenoid biosynthesis inhibitor;
environmental contaminant;
herbicide;
xenobiotic
tebufenozide[no description available]low00carbohydrazideecdysone agonist;
environmental contaminant;
xenobiotic
dpx e9636[no description available]low00aromatic ether;
N-sulfonylurea;
pyridines;
pyrimidines;
sulfone		environmental contaminant;
herbicide;
xenobiotic
arsenocholine[no description available]low00arsonium ion;
organoarsenic compound		human urinary metabolite;
marine metabolite;
xenobiotic
methoxyfenozide[no description available]low00carbohydrazide;
monomethoxybenzene		environmental contaminant;
insecticide;
xenobiotic
thiamethoxam[no description available]medium001,3-thiazoles;
2-nitroguanidine derivative;
organochlorine compound;
oxadiazane		antifeedant;
carcinogenic agent;
environmental contaminant;
neonicotinoid insectide;
xenobiotic
thiacloprid[no description available]low00monochloropyridine;
nitrile;
thiazolidines		environmental contaminant;
neonicotinoid insectide;
xenobiotic
aspartame[no description available]low00carboxylic acid;
dipeptide zwitterion;
dipeptide;
methyl ester		apoptosis inhibitor;
EC 3.1.3.1 (alkaline phosphatase) inhibitor;
environmental contaminant;
micronutrient;
nutraceutical;
sweetening agent;
xenobiotic
2-ethyl-5-carboxypentyl phthalate[no description available]low00phthalic acid monoesterxenobiotic
carpropamid[no description available]low00amide fungicide;
cyclopropylcarboxamide;
monochlorobenzenes		antifungal agrochemical;
EC 4.2.1.94 (scytalone dehydratase) inhibitor;
melanin synthesis inhibitor;
xenobiotic
mesotrione[no description available]low00aromatic ketone;
beta-triketone;
C-nitro compound;
sulfone		carotenoid biosynthesis inhibitor;
EC 1.13.11.27 (4-hydroxyphenylpyruvate dioxygenase) inhibitor;
environmental contaminant;
herbicide;
xenobiotic
dronedarone[no description available]low001-benzofurans;
aromatic ether;
aromatic ketone;
sulfonamide;
tertiary amino compound		anti-arrhythmia drug;
environmental contaminant;
xenobiotic
pinoxaden[no description available]low00pivalate ester;
pyrazolooxadiazepine		agrochemical;
EC 6.4.1.2 (acetyl-CoA carboxylase) inhibitor;
environmental contaminant;
proherbicide;
xenobiotic
2-chloro-n-(4-chlorobiphenyl-2-yl)nicotinamide[no description available]low00anilide fungicide;
biphenyls;
monochlorobenzenes;
pyridinecarboxamide		antifungal agrochemical;
EC 1.3.5.1 [succinate dehydrogenase (quinone)] inhibitor;
environmental contaminant;
xenobiotic
prizes[no description available]low00carboxamidine;
monochloropyridine;
nitrile		environmental contaminant;
neonicotinoid insectide;
xenobiotic
lenticin[no description available]low00amino-acid betaine;
indole alkaloid;
L-tryptophan derivative		fungal metabolite;
plant metabolite;
xenobiotic
cyanoginosin lr[no description available]low00microcystinbacterial metabolite;
EC 3.1.3.16 (phosphoprotein phosphatase) inhibitor;
environmental contaminant;
xenobiotic
dieldrin[no description available]medium00epoxide;
organochlorine compound;
organochlorine insecticide		carcinogenic agent;
xenobiotic
ranitidine[no description available]low00C-nitro compound;
furans;
organic sulfide;
tertiary amino compound		anti-ulcer drug;
drug allergen;
environmental contaminant;
H2-receptor antagonist;
xenobiotic
azoxystrobin[no description available]low00aryloxypyrimidine;
enoate ester;
enol ether;
methoxyacrylate strobilurin antifungal agent;
methyl ester;
nitrile		antifungal agrochemical;
environmental contaminant;
mitochondrial cytochrome-bc1 complex inhibitor;
quinone outside inhibitor;
xenobiotic
sitagliptin[no description available]low00triazolopyrazine;
trifluorobenzene		EC 3.4.14.5 (dipeptidyl-peptidase IV) inhibitor;
environmental contaminant;
hypoglycemic agent;
serine proteinase inhibitor;
xenobiotic
tylosin[no description available]low00aldehyde;
disaccharide derivative;
enone;
leucomycin;
macrolide antibiotic;
monosaccharide derivative		allergen;
bacterial metabolite;
environmental contaminant;
xenobiotic
eprosartan[no description available]low00dicarboxylic acid;
imidazoles;
thiophenes		angiotensin receptor antagonist;
antihypertensive agent;
environmental contaminant;
xenobiotic
kresoxim-methyl[no description available]low00aromatic ether;
methoxyiminoacetate strobilurin antifungal agent;
methyl ester;
oxime O-ether		antifungal agrochemical;
environmental contaminant;
mitochondrial cytochrome-bc1 complex inhibitor;
xenobiotic
pyrachlostrobin[no description available]low00aromatic ether;
carbamate ester;
carbanilate fungicide;
methoxycarbanilate strobilurin antifungal agent;
monochlorobenzenes;
pyrazoles		antifungal agrochemical;
environmental contaminant;
mitochondrial cytochrome-bc1 complex inhibitor;
xenobiotic
microcystin rr[no description available]low00microcystin;
organic molecular entity		bacterial metabolite;
environmental contaminant;
xenobiotic
yunaconitine[no description available]low00acetate ester;
aromatic ether;
benzoate ester;
bridged compound;
diterpene alkaloid;
organic heteropolycyclic compound;
polyether;
secondary alcohol;
tertiary alcohol;
tertiary amino compound		antifeedant;
human urinary metabolite;
phytotoxin;
plant metabolite;
xenobiotic
pymetrozine[no description available]low001,2,4-triazines;
pyridines		antifeedant;
environmental contaminant;
TRPV channel modulator;
xenobiotic
neotame[no description available]low00dipeptideenvironmental contaminant;
sweetening agent;
xenobiotic
flonicamid[no description available]low00nitrile;
organofluorine compound;
pyridinecarboxamide		environmental contaminant;
insecticide;
xenobiotic
microcystin-lf[no description available]low00microcystinbacterial metabolite;
environmental contaminant;
xenobiotic
decarbamylsaxitoxin[no description available]low00alkaloid;
guanidines;
ketone hydrate;
paralytic shellfish toxin;
primary alcohol;
pyrrolopurine		bacterial metabolite;
marine metabolite;
neurotoxin;
toxin;
xenobiotic
mephedrone[no description available]low00amphetamines;
aromatic ketone;
secondary amino compound		environmental contaminant;
xenobiotic
clothianidin[no description available]medium001,3-thiazoles;
2-nitroguanidine derivative;
clothianidin;
organochlorine compound		environmental contaminant;
neonicotinoid insectide;
nicotinic acetylcholine receptor agonist;
xenobiotic
benzquinamide[no description available]low00monocarboxylic acid amideantiemetic;
antipsychotic agent;
H1-receptor antagonist;
muscarinic antagonist;
sedative
nordazepam[no description available]medium001,4-benzodiazepinone;
organochlorine compound		anticonvulsant;
anxiolytic drug;
GABA modulator;
human metabolite;
sedative
doxylamine[no description available]low00pyridines;
tertiary amine		anti-allergic agent;
antiemetic;
antitussive;
cholinergic antagonist;
H1-receptor antagonist;
histamine antagonist;
sedative
methapyrilene[no description available]low00ethylenediamine derivativeanti-allergic agent;
carcinogenic agent;
H1-receptor antagonist;
sedative
nimetazepam[no description available]low001,4-benzodiazepinone;
C-nitro compound		anticonvulsant;
antispasmodic drug;
GABA modulator;
sedative
periciazine[no description available]low00hydroxypiperidine;
nitrile;
phenothiazines		adrenergic antagonist;
first generation antipsychotic;
sedative
propiomazine[no description available]low00aromatic ketone;
phenothiazines;
tertiary amino compound		dopaminergic antagonist;
histamine antagonist;
muscarinic antagonist;
phenothiazine antipsychotic drug;
sedative;
serotonergic antagonist
zopiclone[no description available]low00monochloropyridine;
pyrrolopyrazine		central nervous system depressant;
sedative
promethazine hydrochloride[no description available]low00hydrochlorideanti-allergic agent;
anticoronaviral agent;
antiemetic;
antipruritic drug;
geroprotector;
H1-receptor antagonist;
local anaesthetic;
sedative
methapyrilene hydrochloride[no description available]low00hydrochlorideanti-allergic agent;
carcinogenic agent;
H1-receptor antagonist;
sedative
diphenhydramine hydrochloride[no description available]low00hydrochloride;
organoammonium salt		anti-allergic agent;
antiemetic;
antiparkinson drug;
antipruritic drug;
H1-receptor antagonist;
local anaesthetic;
muscarinic antagonist;
sedative
4-hydroxybutyric acid[no description available]low004-hydroxy monocarboxylic acid;
hydroxybutyric acid		general anaesthetic;
GHB receptor agonist;
neurotoxin;
sedative
terpinolene[no description available]low00p-menthadieneinsect repellent;
plant metabolite;
sedative;
volatile oil component
lormetazepam[no description available]medium001,4-benzodiazepinone;
organochlorine compound		sedative
fenadiazole[no description available]low001,3,4-oxadiazoles;
biaryl;
phenols		sedative
didesethylflurazepam[no description available]medium001,4-benzodiazepinone;
monofluorobenzenes;
organochlorine compound;
primary amino compound		anticonvulsant;
anxiolytic drug;
drug metabolite;
GABAA receptor agonist;
sedative
pregnanolone[no description available]low003-hydroxy-5beta-pregnan-20-one;
3alpha-hydroxy steroid		human metabolite;
intravenous anaesthetic;
sedative
buspirone hydrochloride[no description available]low00hydrochlorideanxiolytic drug;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
sedative;
serotonergic agonist
adinazolam[no description available]low00triazolobenzodiazepineanticonvulsant;
antidepressant;
anxiolytic drug;
sedative
midazolam hydrochloride[no description available]low00hydrochloride;
imidazobenzodiazepine		anticonvulsant;
antineoplastic agent;
anxiolytic drug;
apoptosis inducer;
central nervous system depressant;
GABAA receptor agonist;
general anaesthetic;
muscle relaxant;
sedative
remifentanil[no description available]low00alpha-amino acid ester;
anilide;
monocarboxylic acid amide;
piperidinecarboxylate ester		intravenous anaesthetic;
mu-opioid receptor agonist;
opioid analgesic;
sedative
3-methylfentanyl[no description available]low00monocarboxylic acid amide;
piperidines		mu-opioid receptor agonist;
opioid analgesic;
sedative
brexanolone[no description available]low003-hydroxy-5alpha-pregnan-20-oneantidepressant;
GABA modulator;
human metabolite;
intravenous anaesthetic;
sedative
lactucin[no description available]low00azulenofuran;
cyclic terpene ketone;
enone;
primary alcohol;
secondary alcohol;
sesquiterpene lactone		antimalarial;
plant metabolite;
sedative
etorphine[no description available]low00alcohol;
morphinane alkaloid		opioid analgesic;
opioid receptor agonist;
sedative
eszopiclone[no description available]low00zopiclonecentral nervous system depressant;
sedative
valerenic acid[no description available]low00carbobicyclic compound;
monocarboxylic acid;
sesquiterpenoid		GABA modulator;
plant metabolite;
sedative;
volatile oil component
1-(1-phenylcyclohexyl)pyrrolidine[no description available]low00pyrrolidines;
tertiary amine		general anaesthetic;
hallucinogen;
NMDA receptor antagonist
tricaine[no description available]low00methanesulfonate saltgeneral anaesthetic
alpha-hydroxyglutarate[no description available]low002-hydroxydicarboxylic acid;
dicarboxylic fatty acid		metabolite;
mouse metabolite
alpha-ketoadipic acid[no description available]low00oxo dicarboxylic acidhuman urinary metabolite;
mouse metabolite
3-hydroxyanthranilic acid[no description available]low00aminobenzoic acid;
monohydroxybenzoic acid		human metabolite;
mouse metabolite
3-mercaptopyruvic acid[no description available]low002-oxo monocarboxylic acid;
thiol		antidote to cyanide poisoning;
Escherichia coli metabolite;
human metabolite;
mouse metabolite
n-carbamoyl-beta-alanine[no description available]low00beta-alanine derivativemetabolite;
mouse metabolite
4-aminobutyraldehyde[no description available]low00aminobutanal;
omega-aminoaldehyde		Escherichia coli metabolite;
mouse metabolite
4-hydroxyphenylacetic acid[no description available]low00monocarboxylic acid;
phenols		fungal metabolite;
human metabolite;
mouse metabolite;
plant metabolite
isocaproaldehyde[no description available]low00alpha-CH2-containing aldehydehuman metabolite;
mouse metabolite
aminolevulinic acid[no description available]low004-oxo monocarboxylic acid;
amino acid zwitterion;
delta-amino acid		antineoplastic agent;
dermatologic drug;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
photosensitizing agent;
plant metabolite;
prodrug;
Saccharomyces cerevisiae metabolite
ethylene glycol[no description available]medium00ethanediol;
glycol		metabolite;
mouse metabolite;
solvent;
toxin
acetyl phosphate[no description available]low00acyl monophosphateEscherichia coli metabolite;
human metabolite;
mouse metabolite
agmatine[no description available]low00guanidines;
primary amino compound		Escherichia coli metabolite;
mouse metabolite
allantoic acid[no description available]low00ureasmouse metabolite;
plant metabolite
aminoacetone[no description available]low00methyl ketone;
propanones		Escherichia coli metabolite;
mouse metabolite
ammonium hydroxide[no description available]low00azane;
gas molecular entity;
mononuclear parent hydride		EC 3.5.1.4 (amidase) inhibitor;
metabolite;
mouse metabolite;
neurotoxin;
NMR chemical shift reference compound;
nucleophilic reagent;
refrigerant
anthranilic acid[no description available]low00aminobenzoic acidhuman metabolite;
mouse metabolite
betaine aldehyde[no description available]low00quaternary ammonium ionAspergillus metabolite;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
plant metabolite
hydrobromic acid[no description available]low00gas molecular entity;
hydrogen halide;
mononuclear parent hydride		mouse metabolite
butyraldehyde[no description available]low00butanalsbiomarker;
Escherichia coli metabolite;
mouse metabolite
cadaverine[no description available]low00alkane-alpha,omega-diamineDaphnia magna metabolite;
Escherichia coli metabolite;
mouse metabolite;
plant metabolite
carbamyl phosphate[no description available]low00acyl monophosphate;
one-carbon compound		Escherichia coli metabolite;
mouse metabolite
hydrochloric acid[no description available]low00chlorine molecular entity;
gas molecular entity;
hydrogen halide;
mononuclear parent hydride		mouse metabolite
coproporphyrinogen iii[no description available]low00coproporphyrinogenEscherichia coli metabolite;
mouse metabolite
aminoethylphosphonic acid[no description available]low00phosphonic acids;
primary amino compound;
zwitterion		human metabolite;
metabolite;
mouse metabolite
1,2-dihydroxy-1,2-dihydronaphthalene[no description available]low00dihydronaphthalenes;
naphthalenediols		bacterial xenobiotic metabolite;
mouse metabolite
4-nitrophenylphosphate[no description available]low00aryl phosphatemouse metabolite
trimethylenediamine[no description available]low00alkane-alpha,omega-diaminehuman metabolite;
mouse metabolite;
reagent
n(1)-methylnicotinamide[no description available]low00pyridinium ionalgal metabolite;
anti-inflammatory agent;
human urinary metabolite;
mouse metabolite;
plant metabolite;
Saccharomyces cerevisiae metabolite
phosphonoacetaldehyde[no description available]low00phosphonic acidsmouse metabolite
gamma-guanidinobutyric acid[no description available]low00guanidines;
monocarboxylic acid;
zwitterion		fungal metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
phosphoglycolate[no description available]low00carboxyalkyl phosphateEscherichia coli metabolite;
mouse metabolite
hydrogen selenide[no description available]low00mononuclear parent hydride;
selenium hydride		Escherichia coli metabolite;
mouse metabolite
alpha-keto-delta-guanidinovaleric acid[no description available]low002-oxo monocarboxylic acid;
zwitterion		human metabolite;
mouse metabolite
cytosine[no description available]low00aminopyrimidine;
pyrimidine nucleobase;
pyrimidone		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
3,3-dimethylallyl pyrophosphate[no description available]low00prenol phosphateepitope;
Escherichia coli metabolite;
mouse metabolite;
phosphoantigen
dihydrouracil[no description available]low00pyrimidoneEscherichia coli metabolite;
human metabolite;
metabolite;
mouse metabolite
diethyl phosphate[no description available]low00dialkyl phosphatehuman xenobiotic metabolite;
mouse metabolite
o,o-diethyl phosphorothionate[no description available]low00organic thiophosphatehuman xenobiotic metabolite;
mouse metabolite
dihydrolipoamide[no description available]low00dithiol;
monocarboxylic acid amide		cofactor;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
dihydroxyacetone phosphate[no description available]low00glycerone phosphates;
primary alpha-hydroxy ketone		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
dihydroxyacetone[no description available]low00ketotriose;
primary alpha-hydroxy ketone		antifungal agent;
Escherichia coli metabolite;
human metabolite;
metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
dimethylglycine[no description available]low00amino acid zwitterion;
N-methyl-amino acid;
N-methylglycines		Daphnia magna metabolite;
human metabolite;
mouse metabolite
ethanolamine[no description available]low00ethanolamines;
primary alcohol;
primary amine		Escherichia coli metabolite;
human metabolite;
mouse metabolite
glycocyamine[no description available]low00guanidinoacetic acids;
zwitterion		bacterial metabolite;
human metabolite;
mouse metabolite;
nutraceutical;
rat metabolite
carbonic acid[no description available]low00carbon oxoacid;
chalcocarbonic acid		mouse metabolite
hydantoin-5-propionic acid[no description available]low00imidazolidine-2,4-dione;
monocarboxylic acid		metabolite;
mouse metabolite
hydroxymethylbilane[no description available]low00bilanesEscherichia coli metabolite;
mouse metabolite
indole-3-acetaldehyde[no description available]low00indoleacetaldehydebacterial metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
lactaldehyde[no description available]low00hydroxyaldehyde;
propanals		mouse metabolite
lipoamide[no description available]low00dithiolanes;
monocarboxylic acid amide		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
n-acetylserotonin[no description available]low00acetamides;
N-acylserotonin;
phenols		antioxidant;
human metabolite;
mouse metabolite;
tropomyosin-related kinase B receptor agonist
hydroxide ion[no description available]low00oxygen hydridemouse metabolite
4-nitrophenol[no description available]low004-nitrophenolshuman xenobiotic metabolite;
mouse metabolite
hexadecanal[no description available]low002,3-saturated fatty aldehyde;
long-chain fatty aldehyde		human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
phenanthrene[no description available]low00ortho-fused polycyclic arene;
ortho-fused tricyclic hydrocarbon;
phenanthrenes		environmental contaminant;
mouse metabolite
phenylacetaldehyde[no description available]low00alpha-CH2-containing aldehyde;
phenylacetaldehydes		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
phenethylamine[no description available]low00alkaloid;
aralkylamine;
phenylethylamine		Escherichia coli metabolite;
human metabolite;
mouse metabolite
phosphorylcholine[no description available]low00phosphocholinesallergen;
epitope;
hapten;
human metabolite;
mouse metabolite
phosphorylethanolamine[no description available]low00phosphoethanolamine;
primary amino compound		algal metabolite;
human metabolite;
mouse metabolite
porphobilinogen[no description available]low00aralkylamino compound;
dicarboxylic acid;
pyrroles		Escherichia coli metabolite;
metabolite;
mouse metabolite
propylene glycol[no description available]low00glycol;
propane-1,2-diols		allergen;
human xenobiotic metabolite;
mouse metabolite;
protic solvent
pyridoxal[no description available]low00hydroxymethylpyridine;
methylpyridines;
monohydroxypyridine;
pyridinecarbaldehyde;
vitamin B6		cofactor;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
pyridoxamine[no description available]low00aminoalkylpyridine;
hydroxymethylpyridine;
monohydroxypyridine;
vitamin B6		Escherichia coli metabolite;
human metabolite;
iron chelator;
mouse metabolite;
nephroprotective agent;
plant metabolite;
Saccharomyces cerevisiae metabolite
pyridoxamine phosphate[no description available]low00aminoalkylpyridine;
methylpyridines;
monohydroxypyridine;
vitamin B6 phosphate		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
pyridoxine 5-phosphate[no description available]low00vitamin B6 phosphateEscherichia coli metabolite;
mouse metabolite
sarcosine[no description available]low00N-alkylglycine zwitterion;
N-alkylglycine;
N-methyl-amino acid;
N-methylglycines		Escherichia coli metabolite;
glycine receptor agonist;
glycine transporter 1 inhibitor;
human metabolite;
mouse metabolite
succinic semialdehyde[no description available]low00aldehydic acidEscherichia coli metabolite;
mouse metabolite
tartronate semialdehyde[no description available]low002-hydroxy monocarboxylic acid;
3-oxo monocarboxylic acid;
aldehyde		Escherichia coli metabolite;
mouse metabolite
thymine[no description available]low00pyrimidine nucleobase;
pyrimidone		Escherichia coli metabolite;
human metabolite;
mouse metabolite
tryptamine[no description available]low00aminoalkylindole;
aralkylamino compound;
indole alkaloid;
tryptamines		human metabolite;
mouse metabolite;
plant metabolite
uroporphyrinogen iii[no description available]low00uroporphyrinogenEscherichia coli metabolite;
mouse metabolite
isopentenyl pyrophosphate[no description available]low00prenol phosphateantigen;
antioxidant;
epitope;
Escherichia coli metabolite;
mouse metabolite;
phosphoantigen
perillic acid[no description available]low00alpha,beta-unsaturated monocarboxylic acid;
cyclohexenecarboxylic acid		antineoplastic agent;
human metabolite;
mouse metabolite
6-hydroxymelatonin[no description available]low00acetamides;
tryptamines		metabolite;
mouse metabolite
adrenic acid[no description available]low00docosatetraenoic acidmouse metabolite
benzo(a)pyrene[no description available]low00ortho- and peri-fused polycyclic arenecarcinogenic agent;
mouse metabolite
2,5-dihydroxybenzoic acid[no description available]low00dihydroxybenzoic acidEC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor;
fungal metabolite;
human metabolite;
MALDI matrix material;
mouse metabolite
tele-methylhistamine[no description available]low00imidazoles;
primary amino compound		human metabolite;
mouse metabolite
quinone[no description available]low001,4-benzoquinonescofactor;
human xenobiotic metabolite;
mouse metabolite
1,7-dimethylxanthine[no description available]low00dimethylxanthinecentral nervous system stimulant;
human blood serum metabolite;
human xenobiotic metabolite;
mouse metabolite
theobromine[no description available]low00dimethylxanthineadenosine receptor antagonist;
bronchodilator agent;
food component;
human blood serum metabolite;
mouse metabolite;
plant metabolite;
vasodilator agent
tyramine[no description available]low00monoamine molecular messenger;
primary amino compound;
tyramines		EC 3.1.1.8 (cholinesterase) inhibitor;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
neurotransmitter
thymidine[no description available]low00pyrimidine 2'-deoxyribonucleosideEscherichia coli metabolite;
human metabolite;
metabolite;
mouse metabolite
hydroxyproline[no description available]low004-hydroxyproline;
L-alpha-amino acid zwitterion		human metabolite;
mouse metabolite;
plant metabolite
aldosterone[no description available]low0011beta-hydroxy steroid;
18-oxo steroid;
20-oxo steroid;
21-hydroxy steroid;
3-oxo-Delta(4) steroid;
C21-steroid hormone;
mineralocorticoid;
primary alpha-hydroxy ketone;
steroid aldehyde		human metabolite;
mouse metabolite
androsterone[no description available]low0017-oxo steroid;
3alpha-hydroxy steroid;
androstanoid;
C19-steroid		androgen;
anticonvulsant;
human blood serum metabolite;
human metabolite;
human urinary metabolite;
mouse metabolite;
pheromone
etiocholanolone[no description available]low0017-oxo steroid;
3alpha-hydroxy steroid;
androstanoid		human metabolite;
mouse metabolite
uridine monophosphate[no description available]low00pyrimidine ribonucleoside 5'-monophosphate;
uridine 5'-phosphate		Escherichia coli metabolite;
human metabolite;
mouse metabolite
uridine diphosphate[no description available]low00pyrimidine ribonucleoside 5'-diphosphate;
uridine 5'-phosphate		Escherichia coli metabolite;
mouse metabolite
galactose[no description available]low00D-galactose;
galactopyranose		Escherichia coli metabolite;
mouse metabolite
androstenedione[no description available]low0017-oxo steroid;
3-oxo-Delta(4) steroid;
androstanoid		androgen;
Daphnia magna metabolite;
human metabolite;
mouse metabolite
cytidine monophosphate[no description available]low00cytidine 5'-phosphate;
pyrimidine ribonucleoside 5'-monophosphate		Escherichia coli metabolite;
human metabolite;
mouse metabolite
cytidine diphosphate[no description available]low00cytidine 5'-phosphate;
pyrimidine ribonucleoside 5'-diphosphate		Escherichia coli metabolite;
mouse metabolite
uridine triphosphate[no description available]low00pyrimidine ribonucleoside 5'-triphosphate;
uridine 5'-phosphate		Escherichia coli metabolite;
mouse metabolite
cytidine[no description available]low00cytidinesEscherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
cytidine triphosphate[no description available]low00cytidine 5'-phosphate;
pyrimidine ribonucleoside 5'-triphosphate		Escherichia coli metabolite;
mouse metabolite
1-naphthaldehyde[no description available]low00naphthaldehydemouse metabolite
2-naphthaldehyde[no description available]low00naphthaldehydemouse metabolite
17-alpha-hydroxyprogesterone[no description available]low0017alpha-hydroxy-C21-steroid;
17alpha-hydroxy steroid;
tertiary alpha-hydroxy ketone		human metabolite;
metabolite;
mouse metabolite;
progestin
asparagine[no description available]low00amino acid zwitterion;
asparagine;
aspartate family amino acid;
L-alpha-amino acid;
proteinogenic amino acid		Escherichia coli metabolite;
human metabolite;
micronutrient;
mouse metabolite;
nutraceutical;
plant metabolite;
Saccharomyces cerevisiae metabolite
histidine[no description available]low00amino acid zwitterion;
histidine;
L-alpha-amino acid;
polar amino acid zwitterion;
proteinogenic amino acid		algal metabolite;
Escherichia coli metabolite;
human metabolite;
micronutrient;
mouse metabolite;
nutraceutical;
Saccharomyces cerevisiae metabolite
valine[no description available]low00L-alpha-amino acid zwitterion;
L-alpha-amino acid;
proteinogenic amino acid;
pyruvate family amino acid;
valine		algal metabolite;
Escherichia coli metabolite;
human metabolite;
micronutrient;
mouse metabolite;
nutraceutical;
Saccharomyces cerevisiae metabolite
threonine[no description available]low00amino acid zwitterion;
aspartate family amino acid;
L-alpha-amino acid;
proteinogenic amino acid;
threonine		algal metabolite;
Escherichia coli metabolite;
human metabolite;
micronutrient;
mouse metabolite;
nutraceutical;
plant metabolite;
Saccharomyces cerevisiae metabolite
isoleucine[no description available]low00aspartate family amino acid;
isoleucine;
L-alpha-amino acid zwitterion;
L-alpha-amino acid;
proteinogenic amino acid		algal metabolite;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
plant metabolite;
Saccharomyces cerevisiae metabolite
methylamine[no description available]low00methylamines;
one-carbon compound;
primary aliphatic amine		mouse metabolite
ethylene oxide[no description available]low00gas molecular entity;
oxacycle;
saturated organic heteromonocyclic parent		allergen;
mouse metabolite;
mutagen
vinylidene chloride[no description available]low00chloroethenescarcinogenic agent;
mouse metabolite;
mutagen
gibberellic acid[no description available]low00C19-gibberellin;
gibberellin monocarboxylic acid;
lactone;
organic heteropentacyclic compound		mouse metabolite;
plant metabolite
pyridoxic acid[no description available]low00hydroxymethylpyridine;
methylpyridines;
monohydroxypyridine;
vitamin B6		human urinary metabolite;
mouse metabolite
1-nitronaphthalene[no description available]low00mononitronaphthaleneenvironmental contaminant;
mouse metabolite
beta-glucono-1,5-lactone[no description available]low00aldono-1,5-lactone;
gluconolactone		animal metabolite;
mouse metabolite
2-naphthoic acid[no description available]low00naphthoic acidmouse metabolite;
xenobiotic metabolite
phosphoribosyl pyrophosphate[no description available]low005-O-phosphono-D-ribofuranosyl diphosphateEscherichia coli metabolite;
human metabolite;
mouse metabolite;
plant metabolite
methylphenyl carbinol[no description available]low00aromatic alcoholmouse metabolite
trehalose[no description available]low00trehaloseEscherichia coli metabolite;
geroprotector;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
4-hydroxyacetophenone[no description available]low00monohydroxyacetophenonefungal metabolite;
mouse metabolite;
plant metabolite
styrene[no description available]low00styrenes;
vinylarene;
volatile organic compound		mouse metabolite;
mutagen;
plant metabolite
2-phenylacetamide[no description available]low00monocarboxylic acid amidemouse metabolite
4-bromophenol[no description available]low00bromophenolhuman urinary metabolite;
human xenobiotic metabolite;
marine metabolite;
mouse metabolite;
persistent organic pollutant;
rat metabolite
ethylene dibromide[no description available]low00bromoalkane;
bromohydrocarbon		algal metabolite;
carcinogenic agent;
fumigant;
marine metabolite;
mouse metabolite;
mutagen
bromobenzene[no description available]low00bromoarene;
bromobenzenes;
volatile organic compound		hepatotoxic agent;
mouse metabolite;
non-polar solvent
2-heptanone[no description available]low00dialkyl ketone;
methyl ketone		mouse metabolite;
pheromone
acetol[no description available]low00methyl ketone;
primary alcohol;
primary alpha-hydroxy ketone;
propanones		Escherichia coli metabolite;
human metabolite;
mouse metabolite
2-naphthol[no description available]low00naphtholantinematodal drug;
genotoxin;
human urinary metabolite;
human xenobiotic metabolite;
mouse metabolite;
radical scavenger
pregnenolone[no description available]low0020-oxo steroid;
3beta-hydroxy-Delta(5)-steroid;
C21-steroid		human metabolite;
mouse metabolite
20-alpha-dihydroprogesterone[no description available]low0020-hydroxypregn-4-en-3-onehuman metabolite;
mouse metabolite
D-proline[no description available]low00D-alpha-amino acid zwitterion;
D-alpha-amino acid;
proline		mouse metabolite
diiodotyrosine[no description available]low00diiodotyrosine;
L-tyrosine derivative;
non-proteinogenic L-alpha-amino acid		human metabolite;
mouse metabolite
paraoxon[no description available]low00aryl dialkyl phosphate;
organophosphate insecticide		EC 3.1.1.7 (acetylcholinesterase) inhibitor;
mouse metabolite
aminoimidazole carboxamide[no description available]low00aminoimidazole;
monocarboxylic acid amide		mouse metabolite
methyl-4-tyramine[no description available]low00tyraminesmouse metabolite
citrulline[no description available]low00amino acid zwitterion;
citrulline		Daphnia magna metabolite;
EC 1.14.13.39 (nitric oxide synthase) inhibitor;
Escherichia coli metabolite;
human metabolite;
micronutrient;
mouse metabolite;
nutraceutical;
plant metabolite;
protective agent;
Saccharomyces cerevisiae metabolite
phosphoadenosine phosphosulfate[no description available]low00acyl sulfate;
adenosine bisphosphate;
purine ribonucleoside bisphosphate		Escherichia coli metabolite;
mouse metabolite
adenosine phosphosulfate[no description available]low00acyl monophosphate;
acyl sulfate;
adenosine 5'-phosphate		Escherichia coli metabolite;
mouse metabolite
fructose-1,6-diphosphate[no description available]low00D-fructofuranose 1,6-bisphosphatemouse metabolite
androstenediol[no description available]low0017beta-hydroxy steroid;
3beta-hydroxy-Delta(5)-steroid		androgen;
human metabolite;
mouse metabolite;
radiation protective agent
dihydrotestosterone[no description available]low0017beta-hydroxy steroid;
17beta-hydroxyandrostan-3-one;
3-oxo-5alpha-steroid		androgen;
Daphnia magna metabolite;
human metabolite;
mouse metabolite
pyridoxamine dihydrochloride[no description available]low00hydrochloride;
vitamin B6		Escherichia coli metabolite;
human metabolite;
iron chelator;
mouse metabolite;
nephroprotective agent;
plant metabolite;
Saccharomyces cerevisiae metabolite
hydroxyhydroquinone[no description available]low00benzenetriolmouse metabolite
18-hydroxycorticosterone[no description available]low0011beta-hydroxy steroid;
18-hydroxy steroid;
20-oxo steroid;
21-hydroxy steroid;
3-oxo steroid;
primary alpha-hydroxy ketone		human metabolite;
mouse metabolite
1,2-dihydroxynaphthalene[no description available]low00naphthalenediolmouse metabolite
galactitol[no description available]low00hexitolEscherichia coli metabolite;
human metabolite;
metabolite;
mouse metabolite
2-hydroxyphenylacetic acid[no description available]low00hydroxy monocarboxylic acid;
phenols		human metabolite;
mouse metabolite
propiolaldehyde[no description available]low00terminal acetylenic compound;
ynal		mouse metabolite
dehydroepiandrosterone sulfate[no description available]low0017-oxo steroid;
steroid sulfate		EC 2.7.1.33 (pantothenate kinase) inhibitor;
human metabolite;
mouse metabolite
phenylphosphate[no description available]low00aryl phosphatemouse metabolite
n-cyclohexylformamide[no description available]low00alicyclic compound;
formamides		mouse metabolite
deoxycytidine[no description available]low00pyrimidine 2'-deoxyribonucleosideEscherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
2'-deoxyadenosine[no description available]low00purine 2'-deoxyribonucleoside;
purines 2'-deoxy-D-ribonucleoside		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
cytidine diphosphate choline[no description available]low00nucleotide-(amino alcohol)s;
phosphocholines		human metabolite;
mouse metabolite;
neuroprotective agent;
psychotropic drug;
Saccharomyces cerevisiae metabolite
deoxycytidine monophosphate[no description available]low002'-deoxycytidine phosphate;
pyrimidine 2'-deoxyribonucleoside 5'-monophosphate		Escherichia coli metabolite;
mouse metabolite
nicotinamide mononucleotide[no description available]low00nicotinamide mononucleotideEscherichia coli metabolite;
mouse metabolite
dihydroferulic acid[no description available]low00guaiacols;
monocarboxylic acid;
phenylpropanoid		antioxidant;
human xenobiotic metabolite;
mouse metabolite;
plant metabolite
2'-deoxyadenosine triphosphate[no description available]low002'-deoxyadenosine 5'-phosphate;
purine 2'-deoxyribonucleoside 5'-triphosphate		Escherichia coli metabolite;
mouse metabolite
perillaldehyde[no description available]low00aldehyde;
olefinic compound		human metabolite;
mouse metabolite;
volatile oil component
uridine diphosphate glucuronic acid[no description available]low00UDP-D-glucuronic acidEscherichia coli metabolite;
human metabolite;
mouse metabolite
uridine diphosphate galactose[no description available]low00UDP-D-galactosemouse metabolite
1-naphthalenemethanol[no description available]low00naphthylmethanolmouse metabolite
diadenosine tetraphosphate[no description available]low00diadenosyl tetraphosphateEscherichia coli metabolite;
mouse metabolite
d-glutamate[no description available]low00D-alpha-amino acid;
glutamic acid		Escherichia coli metabolite;
mouse metabolite
hydroiodic acid[no description available]low00gas molecular entity;
hydrogen halide;
mononuclear parent hydride		mouse metabolite
iron[no description available]low00divalent metal cation;
iron cation;
monoatomic dication		cofactor;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
trichloroepoxyethane[no description available]low00epoxidemouse metabolite
acetylgalactosamine[no description available]low00N-acetyl-D-hexosamine;
N-acetylgalactosamine		Escherichia coli metabolite;
human metabolite;
mouse metabolite
phosphopantothenic acid[no description available]low00amidoalkyl phosphateEscherichia coli metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
cyromazine[no description available]low00triamino-1,3,5-triazinemouse metabolite;
triazine insecticide
xanthosine[no description available]low00purines D-ribonucleoside;
xanthosines		Escherichia coli metabolite;
human metabolite;
mouse metabolite
thymidine 5'-triphosphate[no description available]low00pyrimidine 2'-deoxyribonucleoside 5'-triphosphate;
thymidine phosphate		Escherichia coli metabolite;
mouse metabolite
2'-deoxyuridylic acid[no description available]low00deoxyuridine phosphate;
pyrimidine 2'-deoxyribonucleoside 5'-monophosphate		Escherichia coli metabolite;
metabolite;
mouse metabolite
n-acetylaspartic acid[no description available]low00N-acetyl-L-amino acid;
N-acyl-L-aspartic acid		antioxidant;
human metabolite;
mouse metabolite;
nutraceutical;
rat metabolite
deoxyuridine triphosphate[no description available]low00deoxyuridine phosphate;
pyrimidine 2'-deoxyribonucleoside 5'-triphosphate		Arabidopsis thaliana metabolite;
Escherichia coli metabolite;
human metabolite;
mouse metabolite
homocitrulline[no description available]low00amino acid zwitterion;
L-lysine derivative;
non-proteinogenic L-alpha-amino acid;
ureas		human metabolite;
mouse metabolite
2'-deoxycytidine 5'-triphosphate[no description available]low002'-deoxycytidine phosphate;
pyrimidine 2'-deoxyribonucleoside 5'-triphosphate		Escherichia coli metabolite;
human metabolite;
mouse metabolite
aica ribonucleotide[no description available]low001-(phosphoribosyl)imidazolecarboxamide;
aminoimidazole		cardiovascular drug;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
plant metabolite;
Saccharomyces cerevisiae metabolite
obtusifoliol[no description available]low0014alpha-methyl steroid;
3beta-sterol		mouse metabolite;
plant metabolite
lathosterol[no description available]low003beta-sterol;
C27-steroid;
cholestanoid;
Delta(7)-sterol		human metabolite;
mouse metabolite
3'-cmp[no description available]low00cytidine 3'-phosphate;
pyrimidine ribonucleoside 3'-monophosphate		Escherichia coli metabolite;
metabolite;
mouse metabolite
cystine[no description available]low00cystine zwitterion;
cystine;
L-cysteine derivative;
non-proteinogenic L-alpha-amino acid		EC 1.2.1.11 (aspartate-semialdehyde dehydrogenase) inhibitor;
flour treatment agent;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
phenylacetylglycine[no description available]low00monocarboxylic acid amide;
monocarboxylic acid;
N-acylglycine		human metabolite;
mouse metabolite
hordenine[no description available]low00phenethylamine alkaloidhuman metabolite;
mouse metabolite
7-methylxanthine[no description available]low00oxopurine;
purine alkaloid		human xenobiotic metabolite;
mouse metabolite;
plant metabolite
glutaurine[no description available]low00dipeptide zwitterion;
dipeptide;
L-glutamine derivative;
sulfonic acid		anticonvulsant;
anxiolytic drug;
hormone;
human metabolite;
mammalian metabolite;
mouse metabolite
plasmenylserine[no description available]low00O-phosphoserineEC 1.4.7.1 [glutamate synthase (ferredoxin)] inhibitor;
EC 2.5.1.49 (O-acetylhomoserine aminocarboxypropyltransferase) inhibitor;
EC 4.3.1.10 (serine-sulfate ammonia-lyase) inhibitor;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
cifostodine[no description available]low002',3'-cyclic pyrimidine nucleotideEscherichia coli metabolite;
mouse metabolite;
Mycoplasma genitalium metabolite
n'-methyl-2-pyridone-5-carboxamide[no description available]low00methylpyridines;
pyridinecarboxamide;
pyridone		metabolite;
mouse metabolite
1-methyluric acid[no description available]low00oxopurinehuman xenobiotic metabolite;
mouse metabolite
cyclopropylamine[no description available]low00primary aliphatic aminemouse metabolite
5-hydroxymethylcytosine[no description available]low00aminopyrimidine;
aromatic primary alcohol;
nucleobase analogue;
pyrimidone		human metabolite;
mouse metabolite
6-hydroxynicotinic acid[no description available]low00monohydroxypyridineArabidopsis thaliana metabolite;
human urinary metabolite;
mouse metabolite
xanthosine 5'-triphosphate[no description available]low00purine ribonucleoside 5'-monophosphate;
xanthosine 5'-phosphate		Escherichia coli metabolite;
metabolite;
mouse metabolite
2-naphthalenemethanol[no description available]low00naphthylmethanolmouse metabolite;
xenobiotic metabolite
hydroxyindoleacetaldehyde[no description available]low00hydroxyindoles;
indoleacetaldehyde		human metabolite;
mouse metabolite
xanthurenic acid 8-methyl ether[no description available]low00aromatic ether;
monohydroxyquinoline;
quinolinemonocarboxylic acid		carcinogenic agent;
metabolite;
mouse metabolite
glucose[no description available]low00D-glucopyranosemouse metabolite
1,3,7-trimethylurate[no description available]low00oxopurinehuman blood serum metabolite;
human urinary metabolite;
human xenobiotic metabolite;
mouse metabolite
1-methylxanthine[no description available]low001-methylxanthinemouse metabolite
3,7-dimethyluric acid[no description available]low00oxopurinemetabolite;
mouse metabolite
biocytin[no description available]low00azabicycloalkane;
L-alpha-amino acid zwitterion;
L-lysine derivative;
monocarboxylic acid amide;
non-proteinogenic L-alpha-amino acid;
thiabicycloalkane;
ureas		mouse metabolite
3,4-dihydroxymandelic acid[no description available]low002-hydroxy monocarboxylic acid;
catechols		antioxidant;
drug metabolite;
human metabolite;
mouse metabolite
17-alpha-hydroxypregnenolone[no description available]low0017alpha-hydroxy-C21-steroid;
17alpha-hydroxy steroid;
3beta-hydroxy-Delta(5)-steroid;
hydroxypregnenolone;
tertiary alpha-hydroxy ketone		human metabolite;
mouse metabolite
mephentermine[no description available]low002-aminooctadecane-1,3-diolEC 2.7.11.13 (protein kinase C) inhibitor;
human metabolite;
mouse metabolite
3,4-dihydroxyphenylglycol[no description available]low00catechols;
tetrol		metabolite;
mouse metabolite
homocysteine[no description available]low00amino acid zwitterion;
homocysteine;
serine family amino acid		fundamental metabolite;
mouse metabolite
1,7-dimethyluric acid[no description available]low00oxopurinehuman xenobiotic metabolite;
mouse metabolite
24-methylenecholesterol[no description available]low003beta-hydroxy-Delta(5)-steroid;
3beta-sterol		mouse metabolite
succinyl-coenzyme a[no description available]low00omega-carboxyacyl-CoAEscherichia coli metabolite;
inhibitor;
mouse metabolite
acetoacetyl coa[no description available]low003-oxo-fatty acyl-CoAEscherichia coli metabolite;
mouse metabolite
2,8-dihydroxyadenine[no description available]low006-aminopurines;
diol;
heteroaryl hydroxy compound;
oxopurine		human urinary metabolite;
mammalian metabolite;
mouse metabolite;
nephrotoxic agent
5beta-pregnane-3,20-dione[no description available]low0020-oxo steroid;
3-oxo-5beta-steroid;
C21-steroid		human metabolite;
mouse metabolite
zymosterol[no description available]low003beta-sterol;
cholestanoid		human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
propionyl-coenzyme a[no description available]low00acyl-CoAEscherichia coli metabolite;
metabolite;
mouse metabolite
21-deoxycortisol[no description available]low0011beta-hydroxy steroid;
17alpha-hydroxy-C21-steroid;
deoxycortisol;
tertiary alpha-hydroxy ketone		human blood serum metabolite;
mouse metabolite
5,6-dihydrothymine[no description available]low00pyrimidonehuman metabolite;
metabolite;
mouse metabolite
stearoyl-coenzyme a[no description available]low0011,12-saturated fatty acyl-CoA;
long-chain fatty acyl-CoA		Escherichia coli metabolite;
mouse metabolite
imidazoleacetic acid[no description available]low00imidazoles;
monocarboxylic acid		metabolite;
mouse metabolite
1-hydroxyphenanthrene[no description available]low00phenanthrolmouse metabolite
2,5-dihydroxypyridine[no description available]low00dihydroxypyridinemouse metabolite
cerium[no description available]low00cholesteryl estermouse metabolite
zymostenol[no description available]low003beta-sterol;
cholestanoid		human metabolite;
mouse metabolite
16-hydroxydehydroepiandrosterone[no description available]low0016alpha-hydroxy steroid;
17-oxo steroid;
3beta-hydroxy-Delta(5)-steroid;
androstanoid;
secondary alpha-hydroxy ketone		human metabolite;
mouse metabolite
6,6-dimethyl-2-methylenebicyclo(3.1.1)heptan-3-ol[no description available]low00carbobicyclic compound;
pinane monoterpenoid;
secondary alcohol		GABA modulator;
mouse metabolite;
plant metabolite;
volatile oil component
hydrogen sulfite[no description available]low00sulfur oxoanionhuman metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
ecgonine methyl ester[no description available]low00methyl ester;
tertiary amino compound;
tropane alkaloid		analgesic;
central nervous system depressant;
metabolite;
mouse metabolite;
opioid analgesic;
peripheral nervous system drug
2-hydroxyamino-1-methyl-6-phenylimidazo(4,5-b)pyridine[no description available]low00hydroxylamine;
imidazopyridine		carcinogenic agent;
genotoxin;
human xenobiotic metabolite;
mouse metabolite;
mutagen;
neurotoxin;
rat metabolite
cholest-5-en-3 beta,7 alpha-diol[no description available]low003beta-hydroxy-Delta(5)-steroid;
7alpha-hydroxy steroid;
oxysterol		mouse metabolite
hypotaurine[no description available]low00aminosulfinic acid;
zwitterion		human metabolite;
metabolite;
mouse metabolite
s-chloromethylglutathione[no description available]medium00organochlorine compound;
S-substituted glutathione		alkylating agent;
bacterial xenobiotic metabolite;
mouse metabolite
5-acetylamino-6-formylamino-3-methyluracil[no description available]low00formamidopyrimidinemouse metabolite
anserine[no description available]low00beta-alanine derivative;
dipeptide;
zwitterion		animal metabolite;
mouse metabolite
5,6-dihydroxyindole[no description available]low00dihydroxyindolemouse metabolite
androsterone glucuronide[no description available]low00beta-D-glucosiduronic acid;
steroid glucosiduronic acid		human metabolite;
metabolite;
mouse metabolite
estrone-3-glucuronide[no description available]low0017-oxo steroid;
beta-D-glucosiduronic acid;
steroid glucosiduronic acid		human metabolite;
mouse metabolite
5,6-dihydroxy-2-indolylcarboxylic acid[no description available]low00dihydroxyindolemouse metabolite
protoporphyrinogen[no description available]low00porphyrinogensEscherichia coli metabolite;
mouse metabolite
inositol-3,4,5,6-tetrakisphosphate[no description available]low00myo-inositol tetrakisphosphatemouse metabolite
(20s)-20-hydroxycholesterol[no description available]low0020-hydroxy steroid;
3beta-hydroxy-Delta(5)-steroid;
oxysterol		human metabolite;
mouse metabolite
24-hydroxycholesterol[no description available]low0024-hydroxycholesterolbiomarker;
human blood serum metabolite;
mouse metabolite
phytosphingosine[no description available]low00amino alcohol;
sphingoid;
triol		mouse metabolite;
Saccharomyces cerevisiae metabolite
butyryl-coenzyme a[no description available]low00butanoyl-CoAsEscherichia coli metabolite;
mouse metabolite
n-acetylputrescine[no description available]low00N-monoacetylalkane-alpha,omega-diamine;
N-substituted putrescine		metabolite;
mouse metabolite
erythrose 4-phosphate[no description available]low00erythrose phosphateEscherichia coli metabolite;
human metabolite;
mouse metabolite
cdp ethanolamine[no description available]low00nucleotide-(amino alcohol)s;
phosphoethanolamine		mouse metabolite
7 alpha-hydroxy-4-cholesten-3-one[no description available]low003-oxo-Delta(4) steroid;
7alpha-hydroxy steroid;
cholestanoid		human metabolite;
mouse metabolite
galactose-1-phosphate[no description available]low00alpha-D-hexose 1-phosphate;
D-galactopyranose 1-phosphate		Escherichia coli metabolite;
mouse metabolite
gamma-glutamylcysteine[no description available]low00gamma-glutamylcysteineEscherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
27-hydroxycholesterol[no description available]low0026-hydroxycholesterolapoptosis inducer;
human metabolite;
mouse metabolite;
neuroprotective agent
dehydroalanine[no description available]low002,3-dehydroamino acid;
alpha,beta-unsaturated monocarboxylic acid;
amino acid zwitterion;
enamine;
non-proteinogenic alpha-amino acid		alkylating agent;
human metabolite;
mouse metabolite
1-myristoyl-2-palmitoyl-sn-glycero-3-phosphocholine[no description available]low001-acyl-2-hexadecanoyl-sn-glycero-3-phosphocholine;
phosphatidylcholine 30:0;
tetradecanoate ester		mouse metabolite
proline[no description available]low00amino acid zwitterion;
glutamine family amino acid;
L-alpha-amino acid;
proline;
proteinogenic amino acid		algal metabolite;
compatible osmolytes;
Escherichia coli metabolite;
micronutrient;
mouse metabolite;
nutraceutical;
Saccharomyces cerevisiae metabolite
d-glutamine[no description available]low00amino acid zwitterion;
D-alpha-amino acid;
glutamine		mouse metabolite
diquafosol[no description available]low00pyrimidine ribonucleoside 5'-tetraphosphate;
uridine 5'-phosphate		mouse metabolite;
P2Y2 receptor agonist
2'-deoxycytidine diphosphate[no description available]low002'-deoxycytidine phosphate;
pyrimidine 2'-deoxyribonucleoside 5'-diphosphate		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Mycoplasma genitalium metabolite
19-hydroxytestosterone[no description available]low0017beta-hydroxy steroid;
19-hydroxy steroid;
3-oxo-Delta(4) steroid		mouse metabolite
2-hydroxy-1,4-benzoquinone[no description available]low00monohydroxy-1,4-benzoquinonesmouse metabolite
3,4-dihydroxyphenylglycolaldehyde[no description available]low00catechols;
hydroxyaldehyde		human metabolite;
mouse metabolite;
neurotoxin
sorbitol 6-phosphate[no description available]low00alditol 6-phosphate;
glucitol phosphate		Escherichia coli metabolite;
mouse metabolite
adenosine 3'-phosphate-5'-phosphate[no description available]low00adenosine bisphosphateEscherichia coli metabolite;
mouse metabolite
androsterone sulfate[no description available]low0017-oxo steroid;
androstanoid;
steroid sulfate		human metabolite;
mouse metabolite
alpha-ribazole[no description available]low001-ribosylbenzimidazole;
dimethylbenzimidazole		Escherichia coli metabolite;
mouse metabolite
3,7,12-trihydroxycoprostane[no description available]low0012alpha-hydroxy steroid;
3alpha-hydroxy steroid;
7alpha-hydroxy steroid		human metabolite;
mouse metabolite
saccharopine[no description available]low00amino acid opine;
L-lysine derivative		human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
allysine[no description available]low00allysine;
amino acid zwitterion;
aminoadipate semialdehyde;
non-proteinogenic L-alpha-amino acid		human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
orotidylic acid[no description available]low00pyrimidine ribonucleoside 5'-monophosphateEscherichia coli metabolite;
human metabolite;
mouse metabolite
beta-ureidoisobutyric acid[no description available]low00ureidocarboxylic acidhuman metabolite;
mouse metabolite
saicar[no description available]low001-(phosphoribosyl)imidazolecarboxamideEscherichia coli metabolite;
mouse metabolite
kynurenine[no description available]low00amino acid zwitterion;
kynurenine;
non-proteinogenic L-alpha-amino acid		human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
thymidine 5'-diphosphate[no description available]low00pyrimidine 2'-deoxyribonucleoside 5'-diphosphate;
thymidine phosphate		Escherichia coli metabolite;
mouse metabolite
hydromethylthionine[no description available]low00aromatic amine;
phenothiazines;
tertiary amino compound		bacterial xenobiotic metabolite;
fluorochrome;
mouse metabolite;
rat metabolite
5-hydroxykynuramine[no description available]low00hydroxykynurenamine;
primary amino compound		mouse metabolite
sedoheptulose 1,7-bisphosphate[no description available]low00ketoheptose phosphate;
sedoheptulose derivative		Escherichia coli metabolite;
mouse metabolite
sedoheptulose 7-phosphate[no description available]low00ketoheptose phosphate;
sedoheptulose derivative		Escherichia coli metabolite;
human metabolite;
mouse metabolite
thiocysteine[no description available]low00amino acid zwitterion;
S-substituted L-cysteine		human metabolite;
mouse metabolite
diadenosine triphosphate[no description available]low00diadenosyl triphosphatemouse metabolite
carboxyaminoimidazole ribotide[no description available]low001-(phosphoribosyl)imidazole;
aminoimidazole;
imidazole-4-carboxylic acid		Escherichia coli metabolite;
mouse metabolite
isovaleryl-coenzyme a[no description available]low00methylbutanoyl-CoA;
short-chain fatty acyl-CoA		mouse metabolite
lauroyl-coenzyme a[no description available]low00medium-chain fatty acyl-CoAEscherichia coli metabolite;
mouse metabolite
nicotinic acid adenine dinucleotide[no description available]low00nicotinic acid dinucleotideEscherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
4,4-dimethyl-5-alpha-cholesta-(8,24)-dien-3-beta-ol[no description available]low003beta-sterolhuman metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
phenylacetyl-coenzyme a[no description available]low00acyl-CoAEscherichia coli metabolite;
metabolite;
mouse metabolite
5-formamidoimidazole-4-carboxamide ribotide[no description available]low001-(phosphoribosyl)imidazolecarboxamideEscherichia coli metabolite;
mouse metabolite
campesterol[no description available]low003beta-hydroxy-Delta(5)-steroid;
3beta-sterol;
C28-steroid;
phytosterols		mouse metabolite
2'-deoxyadenosine triphosphate[no description available]low002'-deoxyadenosine 5'-phosphate;
purine 2'-deoxyribonucleoside 5'-diphosphate		Escherichia coli metabolite;
human metabolite;
mouse metabolite
cholestane-3,7,12,26-tetrol[no description available]low0012alpha-hydroxy steroid;
26-hydroxy steroid;
3alpha-hydroxy steroid;
7alpha-hydroxy steroid		human metabolite;
mouse metabolite
gamma-glutamyl phosphate[no description available]low00gamma-glutamyl phosphateEscherichia coli metabolite;
mouse metabolite
5-amino-6-ribitylamino-2,4-(1h,3h)pyrimidinedione[no description available]low00aminouracil;
hydroxypyrimidine		Escherichia coli metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
cholic acid[no description available]low0012alpha-hydroxy steroid;
3alpha-hydroxy steroid;
7alpha-hydroxy steroid;
bile acid;
C24-steroid;
trihydroxy-5beta-cholanic acid		human metabolite;
mouse metabolite
androstane-3,17-dione, (5alpha)-isomer[no description available]low003-oxo-5alpha-steroid;
androstane-3,17-dione		mouse metabolite
cholesteryl palmitate[no description available]low00cholesteryl esterhuman metabolite;
mouse metabolite
lanosterol[no description available]low0014alpha-methyl steroid;
3beta-sterol;
tetracyclic triterpenoid		bacterial metabolite;
human metabolite;
mouse metabolite;
plant metabolite;
Saccharomyces cerevisiae metabolite
21-hydroxypregnenolone[no description available]low0021-hydroxy steroid;
hydroxypregnenolone;
primary alpha-hydroxy ketone		mouse metabolite
2-hydroxyestradiol[no description available]low0017beta-hydroxy steroid;
2-hydroxy steroid		carcinogenic agent;
human metabolite;
metabolite;
mouse metabolite;
prodrug
epietiocholanolone[no description available]low0017-oxo steroid;
3beta-hydroxy steroid;
androstanoid		androgen;
animal metabolite;
human blood serum metabolite;
mouse metabolite;
rat metabolite
5-hydroxyisourate[no description available]low00oxopurinehuman metabolite;
mouse metabolite
19-hydroxy-4-androstene-3,17-dione[no description available]low0017-oxo steroid;
19-hydroxy steroid;
3-oxo steroid;
androstanoid		mouse metabolite
taurochenodeoxycholic acid[no description available]low00bile acid taurine conjugatehuman metabolite;
mouse metabolite
glyceraldehyde 3-phosphate[no description available]low00glyceraldehyde 3-phosphatemouse metabolite
5'-methylthioadenosine[no description available]low00thioadenosinealgal metabolite;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
5'-deoxyadenosine[no description available]low005'-deoxyribonucleoside;
adenosines		Escherichia coli metabolite;
human metabolite;
mouse metabolite
ribulose 5-phosphate[no description available]low00ribulose 5-phosphatemouse metabolite
xylulose-5-phosphate, (d)-isomer[no description available]low00xylulose 5-phosphateEscherichia coli metabolite;
mouse metabolite
glycerate 1,3-biphosphate[no description available]low002,3-bisphosphoglyceric acid;
acyl monophosphate		Escherichia coli metabolite;
mouse metabolite
isomaltose[no description available]low00glycosylglucosehuman metabolite;
metabolite;
mouse metabolite
n-acetylneuraminic acid[no description available]low00N-acetylneuraminic acidsantioxidant;
bacterial metabolite;
EC 3.2.1.18 (exo-alpha-sialidase) inhibitor;
human metabolite;
mouse metabolite
carnosine[no description available]low00amino acid zwitterion;
dipeptide		anticonvulsant;
antineoplastic agent;
antioxidant;
Daphnia magna metabolite;
geroprotector;
human metabolite;
mouse metabolite;
neuroprotective agent
raffinose[no description available]low00raffinose family oligosaccharide;
trisaccharide		mouse metabolite;
plant metabolite;
Saccharomyces cerevisiae metabolite
5-hydroxytryptophan[no description available]low005-hydroxytryptophan;
amino acid zwitterion;
hydroxy-L-tryptophan;
non-proteinogenic L-alpha-amino acid		human metabolite;
mouse metabolite;
plant metabolite
xanthosine 5'-triphosphate[no description available]low00purine ribonucleoside 5'-triphosphate;
xanthosine 5'-phosphate		Escherichia coli metabolite;
mouse metabolite
dopaquinone[no description available]low001,2-benzoquinones;
amino acid zwitterion;
L-phenylalanine derivative		human metabolite;
mouse metabolite
pantetheine[no description available]low00pantetheines;
thiol		human metabolite;
metabolite;
mouse metabolite
galactose[no description available]low00D-galactopyranoseepitope;
mouse metabolite
galactose[no description available]low00D-galactopyranosemouse metabolite
s-adenosyl-3-methylthiopropylamine[no description available]low00adenosines;
sulfonium compound		Escherichia coli metabolite;
human urinary metabolite;
mouse metabolite;
rat metabolite
5-diphosphomevalonic acid[no description available]low00carboxyalkyl phosphatehuman metabolite;
mouse metabolite
7-dehydrocholesterol[no description available]low003beta-hydroxy-Delta(5)-steroid;
3beta-sterol;
cholestanoid;
Delta(5),Delta(7)-sterol		human metabolite;
mouse metabolite
6-phosphonoglucono-delta-lactone[no description available]low00aldonolactone phosphateEscherichia coli metabolite;
mouse metabolite
inositol 1,4,5-trisphosphate[no description available]low00myo-inositol trisphosphatemouse metabolite
stachyose[no description available]low00raffinose family oligosaccharide;
tetrasaccharide		mouse metabolite;
plant metabolite
desmosterol[no description available]low003beta-hydroxy-Delta(5)-steroid;
3beta-sterol;
C27-steroid;
cholestanoid		human metabolite;
mouse metabolite
monoiodotyrosine[no description available]low00amino acid zwitterion;
L-tyrosine derivative;
monoiodotyrosine;
non-proteinogenic L-alpha-amino acid		EC 1.14.16.2 (tyrosine 3-monooxygenase) inhibitor;
human metabolite;
mouse metabolite
n'-formylkynurenine[no description available]low00amino acid zwitterion;
N-formylkynurenine;
non-proteinogenic amino acid derivative;
non-proteinogenic L-alpha-amino acid		human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
ketodihydrosphingosine[no description available]low002-amino-1-hydroxyoctadecan-3-onemouse metabolite
nicotinamide-beta-riboside[no description available]low00N-glycosylnicotinamide;
pyridine nucleoside		geroprotector;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
4-hydroxyphenylacetaldehyde[no description available]low00alpha-CH2-containing aldehyde;
phenylacetaldehydes		Escherichia coli metabolite;
human metabolite;
mouse metabolite
androstane-3,17-dione, (5beta)-isomer[no description available]low003-oxo-5beta-steroid;
androstane-3,17-dione		mouse metabolite
trimethyllysine[no description available]low00alpha-amino-acid cationhuman metabolite;
mouse metabolite
inositol 3,4-bisphosphate[no description available]low00myo-inositol bisphosphatehuman metabolite;
mouse metabolite
n-acetylglucosamine-1-phosphate[no description available]low00N-acetyl-D-glucosamine 1-phosphateEscherichia coli metabolite;
human metabolite;
mouse metabolite
pantothenylcysteine 4'-phosphate[no description available]low00L-cysteine derivativeEscherichia coli metabolite;
mouse metabolite
24,25-dihydrolanosterol[no description available]low003beta-sterol;
tetracyclic triterpenoid		human metabolite;
mouse metabolite
2-methoxyestrone[no description available]low0017-oxo steroid;
3-hydroxy steroid;
alicyclic ketone;
aromatic ether;
phenolic steroid;
phenols		human metabolite;
mouse metabolite
dehydroascorbic acid[no description available]low00dehydroascorbic acid;
vitamin C		coenzyme;
mouse metabolite
cortodoxone[no description available]low00deoxycortisol;
glucocorticoid;
primary alpha-hydroxy ketone;
tertiary alpha-hydroxy ketone		human metabolite;
mouse metabolite
estradiol-3-glucuronide[no description available]low0017beta-hydroxy steroid;
beta-D-glucosiduronic acid;
steroid glucosiduronic acid		human metabolite;
mouse metabolite
beta-sulfopyruvic acid[no description available]low00carboxyalkanesulfonic acidmouse metabolite
acetyl adenylate[no description available]low005'-acylphosphoadenosinhuman metabolite;
mouse metabolite
2-hydroxypropylphosphonic acid[no description available]low00phosphonic acids;
secondary alcohol		mouse metabolite
4,4-dimethylcholesta-8,14,24-trienol[no description available]low003beta-sterol;
Delta(14) steroid		human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
inositol-1,4,5,6-tetrakisphosphate[no description available]low00myo-inositol tetrakisphosphatemouse metabolite
maleic acid[no description available]low00butenedioic acidalgal metabolite;
mouse metabolite;
plant metabolite
dephosphocoenzyme a[no description available]low00adenosine 5'-phosphateEscherichia coli metabolite;
human metabolite;
mouse metabolite
arachidonic acid[no description available]low00icosa-5,8,11,14-tetraenoic acid;
long-chain fatty acid;
omega-6 fatty acid		Daphnia galeata metabolite;
EC 3.1.1.1 (carboxylesterase) inhibitor;
human metabolite;
mouse metabolite
n(1)-(5-phosphoribosyl)-5,6-dimethylbenzimidazole[no description available]low001-ribosylbenzimidazole;
dimethylbenzimidazole;
ribose monophosphate		Escherichia coli metabolite;
mouse metabolite
prostaglandin h2[no description available]low00olefinic compound;
oxylipin;
prostaglandins H;
secondary alcohol		mouse metabolite
3-hydroxy-3-methylglutaryl-coenzyme a[no description available]low003-hydroxy-3-methylglutaryl-CoA;
3-hydroxy fatty acyl-CoA		human metabolite;
mouse metabolite
farnesyl pyrophosphate[no description available]low00farnesyl diphosphateEscherichia coli metabolite;
mouse metabolite
geranyl pyrophosphate[no description available]low00polyprenyl diphosphateEscherichia coli metabolite;
mouse metabolite
1,5-dihydro-fad[no description available]low00flavin adenine dinucleotideEscherichia coli metabolite;
mouse metabolite
s-hydroxymethylglutathione[no description available]low00S-substituted glutathioneEscherichia coli metabolite;
mouse metabolite
geranylgeranyl pyrophosphate[no description available]low00geranylgeranyl diphosphatemouse metabolite
cytidine monophosphate n-acetylneuraminic acid[no description available]low00CMP-N-acyl-beta-neuraminic acidmouse metabolite
prostaglandin d2[no description available]low00prostaglandins Dhuman metabolite;
mouse metabolite
hexanoyl-coenzyme a[no description available]low00medium-chain fatty acyl-CoAEscherichia coli metabolite;
human metabolite;
mouse metabolite
4-phosphoerythronate[no description available]low004-phosphoerythronic acidEscherichia coli metabolite;
mouse metabolite
colfosceril palmitate[no description available]low001-acyl-2-hexadecanoyl-sn-glycero-3-phosphocholine;
phosphatidylcholine 32:0		mouse metabolite;
surfactant
lyso-pc[no description available]low001-O-acyl-sn-glycero-3-phosphocholine;
lysophosphatidylcholine 16:0		mouse metabolite
trans-4-coumaric acid[no description available]low004-coumaric acidfood component;
mouse metabolite;
plant metabolite
squalene[no description available]low00triterpenehuman metabolite;
mouse metabolite;
plant metabolite;
Saccharomyces cerevisiae metabolite
flavin-adenine dinucleotide[no description available]low00flavin adenine dinucleotide;
vitamin B2		cofactor;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
prosthetic group
flavin mononucleotide[no description available]low00flavin mononucleotide;
vitamin B2		bacterial metabolite;
coenzyme;
cofactor;
human metabolite;
mouse metabolite
3-hydroxybutyryl-coenzyme a[no description available]low003-hydroxyacyl-CoA;
hydroxybutanoyl-CoA		mouse metabolite
malonyl coenzyme a[no description available]low00malonyl-CoAsEC 2.3.1.21 (carnitine O-palmitoyltransferase) inhibitor;
Escherichia coli metabolite;
metabolite;
mouse metabolite
palmitoyl coenzyme a[no description available]low0011,12-saturated fatty acyl-CoA;
3-substituted propionyl-CoA;
long-chain fatty acyl-CoA;
palmitoyl bioconjugate		Escherichia coli metabolite;
mouse metabolite
dihydrosphingosine 1-phosphate[no description available]low00sphingoid 1-phosphatemouse metabolite
glycerylphosphorylcholine[no description available]low00phosphocholines;
sn-glycerol 3-phosphates		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
neuroprotective agent;
parasympatholytic;
Saccharomyces cerevisiae metabolite
caffeic acid[no description available]low00caffeic acidgeroprotector;
mouse metabolite
coniferyl alcohol[no description available]low00guaiacols;
phenylpropanoid		animal metabolite;
monolignol;
mouse metabolite;
pheromone;
plant metabolite;
volatile oil component
cysteine sulfinic acid[no description available]low00organosulfinic acid;
S-substituted L-cysteine		Escherichia coli metabolite;
human metabolite;
metabotropic glutamate receptor agonist;
mouse metabolite
raphanusamic acid[no description available]low00thiazolidinemonocarboxylic acidArabidopsis thaliana metabolite;
mouse metabolite;
xenobiotic metabolite
isobutyryl-coenzyme a[no description available]low00methyl-branched fatty acyl-CoA;
short-chain fatty acyl-CoA		human metabolite;
mouse metabolite
dihydroxycoprostane[no description available]low003alpha-hydroxy steroid;
7alpha-hydroxy steroid		human metabolite;
mouse metabolite
glutaryl-coenzyme a[no description available]low00glutaryl-CoAsmouse metabolite
sphingosine[no description available]low00sphing-4-eninehuman metabolite;
mouse metabolite
leukotriene a4[no description available]low00epoxy fatty acid;
leukotriene;
long-chain fatty acid;
oxylipin;
polyunsaturated fatty acid		human metabolite;
mouse metabolite;
plant metabolite
11-cis-retinal[no description available]low00retinalchromophore;
human metabolite;
mouse metabolite
leukotriene b4[no description available]low00dihydroxy monocarboxylic acid;
hydroxy polyunsaturated fatty acid;
leukotriene;
long-chain fatty acid		human metabolite;
mouse metabolite;
plant metabolite;
vasoconstrictor agent
leukotriene c4[no description available]low00leukotrienebronchoconstrictor agent;
human metabolite;
mouse metabolite
thromboxane a2[no description available]low00epoxy monocarboxylic acid;
thromboxanes A		mouse metabolite
15-hydroxy-5,8,11,13-eicosatetraenoic acid[no description available]low00(5Z,8Z,11Z,13E)-15-HETEhuman metabolite;
mouse metabolite
5-hydroxy-6,8,11,14-eicosatetraenoic acid[no description available]low00HETEhuman metabolite;
mouse metabolite
arachidonic acid 5-hydroperoxide[no description available]low005-HPETEmouse metabolite
leukotriene d4[no description available]low00dipeptide;
leukotriene;
organic sulfide		bronchoconstrictor agent;
human metabolite;
mouse metabolite
prostaglandin g2[no description available]low00prostaglandins Ghuman metabolite;
mouse metabolite
6-ketoprostaglandin f1 alpha[no description available]low00prostaglandins Falphahuman metabolite;
mouse metabolite
arachidonic acid omega-9 hydroperoxide[no description available]low00HPETEmouse metabolite
15-hydroperoxy-5,8,11,13-eicosatetraenoic acid, (s)-(e,z,z,z)-isomer[no description available]low0015-HPETEmouse metabolite
gamma-linolenic acid[no description available]low00linolenic acid;
omega-6 fatty acid		human metabolite;
mouse metabolite;
plant metabolite
alpha-linolenic acid[no description available]low00linolenic acid;
omega-3 fatty acid		micronutrient;
mouse metabolite;
nutraceutical
1-palmitoyl-2-oleoyl-sn-glycerol[no description available]low001,2-diacyl-sn-glycerol;
1-palmitoyl-2-oleoylglycerol		mouse metabolite
epoprostenol[no description available]low00prostaglandins Imouse metabolite
9-hydroxy-10,12-octadecadienoic acid[no description available]low00HODE;
octadecadienoic acid		human metabolite;
metabolite;
mouse metabolite;
plant metabolite
thromboxane b2[no description available]low00thromboxanes Bhuman metabolite;
mouse metabolite
thromboxane b3[no description available]low00thromboxanes Bhuman metabolite;
mouse metabolite
11,12-dihydroxyeicosatrienoic acid[no description available]low00DHETmouse metabolite
14,15-dihydroxyeicosatrienoic acid[no description available]low00DHET;
diol;
secondary allylic alcohol		mouse metabolite
20-hydroxy-5,8,11,14-eicosatetraenoic acid[no description available]low00HETE;
hydroxy monocarboxylic acid		human metabolite;
mouse metabolite
5-oxo-6,8,11,14-eicosatetraenoic acid[no description available]low00oxoicosatetraenoic acidhuman metabolite;
immunomodulator;
mouse metabolite
5,6-epoxy-8,11,14-eicosatrienoic acid[no description available]low00EETmouse metabolite
8,9-epoxyeicosatrienoic acid[no description available]low00EETmouse metabolite
1-palmitoyl-2-oleoylphosphatidylethanolamine, (z & r)-isomer[no description available]low001,2-diacyl-sn-glycero-3-phosphoethanolamine;
phosphatidylethanolamine 34:1 zwitterion;
phosphatidylethanolamine		mouse metabolite
sphingosine 1-phosphate[no description available]low00sphingoid 1-phosphatemouse metabolite;
signalling molecule;
sphingosine-1-phosphate receptor agonist;
T-cell proliferation inhibitor;
vasodilator agent
cholesteryl oleate[no description available]low00CE(18:1);
cholesteryl octadec-9-enoate		mouse metabolite
calcifediol[no description available]low00D3 vitamins;
diol;
hydroxycalciol		bone density conservation agent;
human metabolite;
metabolite;
mouse metabolite;
nutraceutical
hyodeoxycholic acid[no description available]low005beta-cholanic acids;
6alpha,20xi-murideoxycholic acid;
bile acid;
C24-steroid		human metabolite;
mouse metabolite
cerium[no description available]low00CE(18:2);
cholesteryl octadeca-9,12-dienoate		human metabolite;
mouse metabolite
xylulose[no description available]low00xyluloseEscherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
11-dehydrocorticosterone[no description available]low0011-oxo steroid;
20-oxo steroid;
21-hydroxy steroid;
3-oxo-Delta(4) steroid;
corticosteroid;
primary alpha-hydroxy ketone		human metabolite;
mouse metabolite
stearidonic acid[no description available]low00long-chain fatty acid;
octadecatetraenoic acid;
omega-3 fatty acid		Daphnia galeata metabolite;
mouse metabolite;
plant metabolite
trilinolein[no description available]low001,2-diacyl-3-linoleoylglycerol;
1,3-diacyl-2-linoleoylglycerol;
linoleoyl containing 1,2,3-triacyl-sn-glycerol;
TG(18:2/18:2/18:2);
triglyceride		mouse metabolite
dimyristoylphosphatidylcholine[no description available]low001,2-diacyl-sn-glycero-3-phosphocholine;
phosphatidylcholine 28:0;
tetradecanoate ester		antigen;
mouse metabolite
2,3-oxidosqualene[no description available]low002,3-epoxysqualenehuman metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
deoxyribose[no description available]low00deoxypentosehuman metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
monodehydroascorbate[no description available]low00organic radicalmouse metabolite
oleoyl-coenzyme a[no description available]low00octadecenoyl-CoAEscherichia coli metabolite;
mouse metabolite
vitamin a2[no description available]low00retinoid;
vitamin A		human xenobiotic metabolite;
marine xenobiotic metabolite;
mouse metabolite
1,2-dioleoylphosphatidylserine[no description available]low00phosphatidylserine(18:1/18:1)mouse metabolite
5-hydroxy-6,8,11,14,17-eicosapentaenoic acid[no description available]low00HEPEmouse metabolite
1-stearoyl-2-linoleoylphosphatidylcholine[no description available]low00phosphatidylcholine 36:2mouse metabolite
1-stearoyl-2-linoleoyl-sn-glycerol[no description available]low001,2-diacyl-sn-glycerol;
diacylglycerol 36:2		mouse metabolite
1-palmitoyl-2-docosahexaenoyl-sn-glycero-3-phosphocholine[no description available]low00phosphatidylcholine 38:6mouse metabolite
13(S)-HODE[no description available]low00HODEantineoplastic agent;
human xenobiotic metabolite;
mouse metabolite
1-stearoyl-2-oleoyl-sn-glycerol[no description available]low001,2-diacyl-sn-glycerol;
1-stearoyl-2-oleoylglycerol;
diacylglycerol 36:1		mouse metabolite
1-palmitoyl-2-palmitoleoyl-sn-glycero-3-phosphocholine[no description available]low001-acyl-2-palmitoleoyl-sn-glycero-3-phosphocholine;
phosphatidylcholine 32:1		mouse metabolite
13-oxo-9,11-octadecadienoic acid[no description available]low0013-oxo-9,11-octadecadienoic acidmetabolite;
mouse metabolite
n-stearoylsphingomyelin[no description available]low00sphingomyelin 36:1;
sphingomyelin d18:1		mouse metabolite
20,22-dihydroxycholesterol[no description available]low0020-hydroxy steroid;
22-hydroxy steroid;
3beta-hydroxy-Delta(5)-steroid;
3beta-sterol;
cholestanoid;
oxysterol		human metabolite;
mouse metabolite
cholesteryl arachidonate[no description available]low00cholesteryl icosatetraenoateantibacterial agent;
mouse metabolite
acryloyl-coenzyme a[no description available]low002-enoyl-CoA;
monounsaturated fatty acyl-CoA		mouse metabolite
samarium[no description available]low00sphingomyelin d18:1/16:0mouse metabolite
n-palmitoylgalactosylsphingosine[no description available]low00HexCer(d18:1/16:0);
N-acyl-beta-D-galactosylsphingosine		mouse metabolite
palmitoylcarnitine[no description available]low00O-palmitoylcarnitine;
saturated fatty acyl-L-carnitine		EC 3.6.3.9 (Na(+)/K(+)-transporting ATPase) inhibitor;
human metabolite;
mouse metabolite
s-tetradecanoyl-coenzyme a[no description available]low0011,12-saturated fatty acyl-CoA;
long-chain fatty acyl-CoA		Escherichia coli metabolite;
mouse metabolite
prosomatostatin[no description available]low00heterodetic cyclic peptide;
peptide hormone		fungal metabolite;
mouse metabolite;
rat metabolite
phosphatidylcholines[no description available]low00phosphatidylcholine 40:6mouse metabolite
2-ketoarginine[no description available]low002-oxo monocarboxylic acid;
zwitterion		human metabolite;
mouse metabolite
cyclosporine[no description available]low00keto-disaccharidemouse metabolite
g(m3) ganglioside[no description available]low00alpha-N-acetylneuraminyl-(2->3)-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-ceramide;
sialodiosylceramide;
sialotriaosylceramide		mouse metabolite
diguanosine tetraphosphate[no description available]low00guanosine 5'-phosphate;
purine ribonucleoside 5'-tetraphosphate		Escherichia coli metabolite;
mouse metabolite
deoxyinosine[no description available]low00purine 2'-deoxyribonucleoside;
purines 2'-deoxy-D-ribonucleoside		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
plant metabolite;
Saccharomyces cerevisiae metabolite
2'-deoxyguanosine 5'-phosphate[no description available]low00deoxyguanosine phosphate;
guanyl deoxyribonucleotide;
purine 2'-deoxyribonucleoside 5'-monophosphate		Escherichia coli metabolite;
mouse metabolite
deoxyguanosine triphosphate[no description available]low00deoxyguanosine phosphate;
guanyl deoxyribonucleotide;
purine 2'-deoxyribonucleoside 5'-triphosphate		Arabidopsis thaliana metabolite;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
plant metabolite;
Saccharomyces cerevisiae metabolite
7,8-dihydroneopterin[no description available]low00dihydropterin;
neopterins		Escherichia coli metabolite;
human metabolite;
metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
dihydrofolate[no description available]low00dihydrofolic acidsEscherichia coli metabolite;
mouse metabolite
dihydroneopterin triphosphate[no description available]low00dihydropterin;
neopterins;
pterin phosphate		Escherichia coli metabolite;
mouse metabolite
deoxyinosine monophosphate[no description available]low00deoxyinosine phosphate;
purine 2'-deoxyribonucleoside 5'-monophosphate		Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Mycoplasma genitalium metabolite
2'-deoxyinosine triphosphate[no description available]low00deoxyinosine phosphate;
purine 2'-deoxyribonucleoside 5'-triphosphate		Escherichia coli metabolite;
mouse metabolite
guanosine diphosphate[no description available]low00guanosine 5'-phosphate;
purine ribonucleoside 5'-diphosphate		Escherichia coli metabolite;
mouse metabolite;
uncoupling protein inhibitor
gdp-4-keto-6-deoxymannose[no description available]low00GDP-sugarEscherichia coli metabolite;
mouse metabolite
guanosine diphosphate mannose[no description available]low00GDP-D-mannoseEscherichia coli metabolite;
human metabolite;
mouse metabolite;
plant metabolite
guanosine pentaphosphate[no description available]low00guanosine 5'-phosphate;
guanosine bisphosphate		Escherichia coli metabolite;
mouse metabolite
guanosine monophosphate[no description available]low00guanosine 5'-phosphate;
purine ribonucleoside 5'-monophosphate		biomarker;
Escherichia coli metabolite;
metabolite;
mouse metabolite
guanosine triphosphate[no description available]low00guanosine 5'-phosphate;
purine ribonucleoside 5'-triphosphate		Escherichia coli metabolite;
mouse metabolite;
uncoupling protein inhibitor
guanine[no description available]low002-aminopurines;
oxopurine;
purine nucleobase		algal metabolite;
Escherichia coli metabolite;
human metabolite;
mouse metabolite;
Saccharomyces cerevisiae metabolite
guanosine tetraphosphate[no description available]low00guanosine bisphosphateEscherichia coli metabolite;
mouse metabolite
inosinic acid[no description available]low00inosine phosphate;
purine ribonucleoside 5'-monophosphate		Escherichia coli metabolite;
human metabolite;
mouse metabolite
inosine triphosphate[no description available]low00inosine phosphate;
purine ribonucleoside 5'-triphosphate		Escherichia coli metabolite;
human metabolite;
mouse metabolite
dyspropterin[no description available]low00biopterins;
tetrahydropterin		human metabolite;
metabolite;
mouse metabolite
5,10-methenyltetrahydrofolate[no description available]low00methylenetetrahydrofolic acidEscherichia coli metabolite;
mouse metabolite
10-formyltetrahydrofolate[no description available]low00formyltetrahydrofolic acidEscherichia coli metabolite;
mouse metabolite
hydrobenzoin[no description available]low00ethanediol
3-chloroalanine[no description available]low00chloroalanine;
non-proteinogenic alpha-amino acid;
organochlorine compound
4-(2,4-dichlorophenoxy)butyric acid[no description available]low00aromatic ether;
monocarboxylic acid;
organochlorine compound		agrochemical;
phenoxy herbicide;
synthetic auxin
2-hydroxysaclofen[no description available]low00organochlorine compound
3,4-dichloroisocoumarin[no description available]low00isocoumarins;
organochlorine compound		geroprotector;
serine protease inhibitor
5-(n,n-hexamethylene)amiloride[no description available]low00aromatic amine;
azepanes;
guanidines;
monocarboxylic acid amide;
organochlorine compound;
pyrazines		antineoplastic agent;
apoptosis inducer;
odorant receptor antagonist;
sodium channel blocker
ethylisopropylamiloride[no description available]low00aromatic amine;
guanidines;
monocarboxylic acid amide;
organochlorine compound;
pyrazines;
tertiary amino compound		anti-arrhythmia drug;
neuroprotective agent;
sodium channel blocker
7-chlorokynurenic acid[no description available]low00organochlorine compound;
quinolinemonocarboxylic acid		neuroprotective agent;
NMDA receptor antagonist
amodiaquine[no description available]low00aminoquinoline;
organochlorine compound;
phenols;
secondary amino compound;
tertiary amino compound		anticoronaviral agent;
antimalarial;
drug allergen;
EC 2.1.1.8 (histamine N-methyltransferase) inhibitor;
non-steroidal anti-inflammatory drug;
prodrug
benzylhydrochlorothiazide[no description available]low00benzenes;
benzothiadiazine;
organochlorine compound;
secondary amino compound;
sulfonamide
cgs 15943[no description available]low00aromatic amine;
biaryl;
furans;
organochlorine compound;
primary amino compound;
quinazolines;
triazoloquinazoline		adenosine A1 receptor antagonist;
adenosine A2A receptor antagonist;
antineoplastic agent;
central nervous system stimulant
chloroxine[no description available]low00monohydroxyquinoline;
organochlorine compound		antibacterial agent;
antifungal drug;
antiseborrheic
clobenpropit[no description available]low00imidazoles;
imidothiocarbamic ester;
organochlorine compound		H3-receptor antagonist;
H4-receptor agonist
cloxyquin[no description available]low00organochlorine compound;
quinolines
coumaphos[no description available]low00organic thiophosphate;
organochlorine compound;
organothiophosphate insecticide		acaricide;
agrochemical;
antinematodal drug;
avicide;
EC 3.1.1.8 (cholinesterase) inhibitor
cypermethrin[no description available]low00aromatic ether;
cyclopropanecarboxylate ester;
nitrile;
organochlorine compound		agrochemical;
molluscicide;
pyrethroid ester acaricide;
pyrethroid ester insecticide
fludiazepam[no description available]low001,4-benzodiazepinone;
organochlorine compound;
organofluorine compound		anxiolytic drug
hydroxychloroquine[no description available]low00aminoquinoline;
organochlorine compound;
primary alcohol;
secondary amino compound;
tertiary amino compound		anticoronaviral agent;
antimalarial;
antirheumatic drug;
dermatologic drug
loratadine[no description available]low00benzocycloheptapyridine;
ethyl ester;
N-acylpiperidine;
organochlorine compound;
tertiary carboxamide		anti-allergic agent;
cholinergic antagonist;
geroprotector;
H1-receptor antagonist
2-(4-morpholinyl)-8-phenyl-4h-1-benzopyran-4-one[no description available]low00chromones;
morpholines;
organochlorine compound		autophagy inhibitor;
EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor;
geroprotector
meclofenamic acid[no description available]low00aminobenzoic acid;
organochlorine compound;
secondary amino compound		analgesic;
anticonvulsant;
antineoplastic agent;
antipyretic;
antirheumatic drug;
EC 1.13.11.34 (arachidonate 5-lipoxygenase) inhibitor;
EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
non-steroidal anti-inflammatory drug
metolachlor[no description available]low00aromatic amide;
benzenes;
ether;
organochlorine compound
metolazone[no description available]low00organochlorine compound;
quinazolines;
sulfonamide		antihypertensive agent;
diuretic;
ion transport inhibitor
mosapramine[no description available]low00azaspiro compound;
dibenzoazepine;
organochlorine compound;
tertiary amino compound
n-(4-aminobutyl)-5-chloro-2-naphthalenesulfonamide[no description available]low00naphthalenes;
organochlorine compound;
primary amino compound;
sulfonamide
naled[no description available]low00dialkyl phosphate;
organobromine compound;
organochlorine compound;
organophosphate insecticide		acaricide;
agrochemical;
antibacterial agent;
antifungal agent;
EC 3.1.1.7 (acetylcholinesterase) inhibitor;
EC 3.1.1.8 (cholinesterase) inhibitor
7-chloro-3-methyl-1-phenyl-1,2,4,5-tetrahydro-3-benzazepin-8-ol[no description available]low00benzazepine;
organochlorine compound;
tertiary amino compound		dopaminergic antagonist
tulobuterol[no description available]low00organochlorine compound
pirinixic acid[no description available]low00aryl sulfide;
organochlorine compound;
pyrimidines
chlorquinaldol[no description available]low00monohydroxyquinoline;
organochlorine compound		antibacterial drug;
antiprotozoal drug;
antiseptic drug
1,1-dichloroethane[no description available]low00organochlorine compound
chloropentafluoroethane[no description available]low00organochlorine compound;
organofluorine compound
sulfachlorpyridazine[no description available]low00organochlorine compound;
pyridazines;
sulfonamide		antibacterial drug;
drug allergen;
EC 2.5.1.15 (dihydropteroate synthase) inhibitor
thiopropazate[no description available]low00acetate ester;
N-alkylpiperazine;
organochlorine compound;
phenothiazines		dopaminergic antagonist;
phenothiazine antipsychotic drug
hexachlorobutadiene[no description available]low00organochlorine compound
symclosene[no description available]low001,3,5-triazinanes;
organochlorine compound
3,3'-dichlorobenzidine[no description available]low00biphenyls;
monochlorobenzenes;
organochlorine compound
1,2-dibromo-3-chloropropane[no description available]low00organochlorine compound
1,2,3-trichloropropane[no description available]low00organochlorine compound
1,3-dichloro-2-propanol[no description available]low00organochlorine compound;
secondary alcohol		cross-linking reagent;
protic solvent
benzotrichloride[no description available]low00benzenes;
organochlorine compound;
volatile organic compound		carcinogenic agent
epichlorohydrin[no description available]low00epoxide;
organochlorine compound
1-bromo-2-chloroethane[no description available]low00haloalkane;
organobromine compound;
organochlorine compound		mutagen
allyl chloride[no description available]low00organochlorine compound
cyanuric chloride[no description available]low00chloro-1,3,5-triazine;
organochlorine compound		cross-linking reagent
chlorendic acid[no description available]low00bridged compound;
dicarboxylic acid;
organochlorine compound		carcinogenic agent
tris(chloroethyl)phosphate[no description available]low00organochlorine compound;
trialkyl phosphate
captan[no description available]low00isoindoles;
organochlorine compound;
organosulfur compound;
phthalimide fungicide		antifungal agrochemical
folpet[no description available]low00organochlorine compound;
organosulfur compound;
phthalimide fungicide		antifungal agrochemical
trichloronate[no description available]low00organochlorine compound
bromochlorodifluoromethane[no description available]low00one-carbon compound;
organobromine compound;
organochlorine compound;
organofluorine compound
metofenazate[no description available]low00N-alkylpiperazine;
organochlorine compound;
phenothiazines
1-chloro-2-methylpropene[no description available]low00organochlorine compound
8-chlorotheophylline[no description available]low00organochlorine compound;
purines		central nervous system stimulant
1,3-dichloroacetone[no description available]low00ketone;
organochlorine compound
bis(chloromethyl) ether[no description available]low00ether;
organochlorine compound		alkylating agent;
carcinogenic agent
trichloroacetonitrile[no description available]low00aliphatic nitrile;
organochlorine compound
3-chloro-2-methylprop-1-ene[no description available]low00organochlorine compound
2,6-dichlorobenzoquinone[no description available]low001,4-benzoquinones;
organochlorine compound		carcinogenic agent;
poison
n-dichlorofluoromethylthio-n',n'-dimethyl-n-p-tolylsulfamide[no description available]low00organochlorine compound;
organofluorine compound;
phenylsulfamide fungicide;
sulfamides		antifungal agrochemical;
genotoxin
2-chloro-1,4-naphthoquinone[no description available]low001,4-naphthoquinones;
organochlorine compound
chlordecone alcohol[no description available]low00organochlorine compound
dichlofluanid[no description available]low00organochlorine compound;
organofluorine compound;
phenylsulfamide fungicide;
sulfamides		acaricide;
antifungal agrochemical
win 18446[no description available]low00organochlorine compound;
secondary carboxamide		EC 1.2.1.3 [aldehyde dehydrogenase (NAD(+))] inhibitor
bromocyclen[no description available]low00organochlorine compound
5-chlorouracil[no description available]low00organochlorine compound
dienochlor[no description available]low00organochlorine compound
captafol[no description available]low00isoindoles;
organochlorine compound;
organosulfur compound;
phthalimide fungicide		antifungal agrochemical
etridiazol[no description available]low00aromatic ether;
organochlorine compound;
thiadiazole antifungal agent;
thiadiazoles		antifungal agrochemical;
nitrification inhibitor
diloxanide furoate[no description available]low00carboxylic ester;
furans;
organochlorine compound;
tertiary carboxamide		antiamoebic agent;
prodrug
dichloroacetylene[no description available]low00organochlorine compound
chloroethylene oxide[no description available]low00organochlorine compound
4-chloro-7-nitrobenzofurazan[no description available]low00benzoxadiazole;
C-nitro compound;
organochlorine compound		EC 1.4.3.4 (monoamine oxidase) inhibitor;
EC 3.6.1.3 (adenosinetriphosphatase) inhibitor;
fluorescent probe;
fluorochrome
ornidazole[no description available]low00C-nitro compound;
imidazoles;
organochlorine compound;
secondary alcohol		antiamoebic agent;
antibacterial drug;
antiinfective agent;
antiprotozoal drug;
antitrichomonal drug;
epitope
acridine half-mustard[no description available]low00aminoacridines;
aromatic ether;
organochlorine compound;
secondary amino compound		mutagen
clonixin[no description available]low00aminopyridine;
organochlorine compound;
pyridinemonocarboxylic acid		antipyretic;
EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
lipoxygenase inhibitor;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug;
platelet aggregation inhibitor;
vasodilator agent
1-chloro-2-propanol[no description available]low00organochlorine compound;
secondary alcohol
pyoluteorin[no description available]low00aromatic ketone;
beta-hydroxy ketone;
diol;
organochlorine compound;
organochlorine pesticide;
polyketide;
pyrroles;
resorcinols		antibacterial agent;
antifungal agent;
apoptosis inducer;
bacterial metabolite;
marine metabolite
triforine[no description available]low00amide fungicide;
formamides;
N-alkylpiperazine;
organochlorine compound		allergen;
antifungal agrochemical;
EC 1.14.13.70 (sterol 14alpha-demethylase) inhibitor
oxamethacin[no description available]low00aromatic ether;
hydroxamic acid;
N-acylindole;
organochlorine compound		EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug
norflurazone[no description available]low00(trifluoromethyl)benzenes;
organochlorine compound;
pyridazinone;
secondary amino compound		agrochemical;
carotenoid biosynthesis inhibitor;
herbicide
octachlorostyrene[no description available]low00organochlorine compound
perfosfamide[no description available]low00nitrogen mustard;
organochlorine compound;
peroxol;
phosphorodiamide		alkylating agent;
antineoplastic agent;
drug allergen;
immunosuppressive agent;
metabolite
tiamenidine[no description available]low00organochlorine compound
acifluorfen[no description available]low00aromatic ether;
benzoic acids;
C-nitro compound;
monocarboxylic acid;
organochlorine compound;
organofluorine compound		agrochemical;
EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor;
herbicide
haloxyfop[no description available]low00aromatic ether;
monocarboxylic acid;
organochlorine compound;
organofluorine compound;
pyridines
quizalofop-ethyl[no description available]low00aromatic ether;
ethyl ester;
organochlorine compound;
quinoxaline derivative
cicletanine[no description available]low00organochlorine compound
lonapalene[no description available]low00naphthalenes;
organochlorine compound
sertindole[no description available]low00heteroarylpiperidine;
imidazolidinone;
organochlorine compound;
organofluorine compound;
phenylindole		alpha-adrenergic antagonist;
H1-receptor antagonist;
second generation antipsychotic;
serotonergic antagonist
ziprasidone[no description available]low001,2-benzisothiazole;
indolones;
organochlorine compound;
piperazines		antipsychotic agent;
dopaminergic antagonist;
histamine antagonist;
muscarinic antagonist;
psychotropic drug;
serotonergic antagonist
tiludronic acid[no description available]low00organochlorine compound
r 29148[no description available]low00organochlorine compound;
oxazolidines;
tertiary carboxamide		herbicide safener
heptenophos[no description available]low00organochlorine compound;
organophosphate insecticide;
trialkyl phosphate		acaricide;
agrochemical;
EC 3.1.1.7 (acetylcholinesterase) inhibitor
ro 5-3335[no description available]low001,4-benzodiazepinone;
organochlorine compound;
pyrroles		anti-HIV-1 agent;
antineoplastic agent;
HIV-1 Tat inhibitor;
RUNX1 inhibitor
5-bromo-4-chloro-3-indolyl beta-galactoside[no description available]low00beta-D-galactoside;
D-aldohexose derivative;
indolyl carbohydrate;
organobromine compound;
organochlorine compound		chromogenic compound
5-bromo-4-chloro-3-indoxyl phosphate[no description available]low00aryl phosphate;
indoles;
organobromine compound;
organochlorine compound		chromogenic compound
z 424[no description available]low00organochlorine compound
tianeptine[no description available]low00dibenzothiazepine;
monocarboxylic acid;
organochlorine compound
clobuzarit[no description available]low00biphenyls;
organochlorine compound
eberconazole[no description available]low00dibenzannulene;
imidazoles;
organochlorine compound
gr 117289[no description available]low001-benzofurans;
biaryl;
imidazolyl carboxylic acid;
monocarboxylic acid;
organobromine compound;
organochlorine compound;
tetrazoles		angiotensin receptor antagonist;
antihypertensive agent
rebeccamycin[no description available]low00indolocarbazole;
N-glycosyl compound;
organic heterohexacyclic compound;
organochlorine compound
triasulfuron[no description available]low001,3,5-triazines;
aromatic ether;
N-sulfonylurea;
organochlorine compound		agrochemical;
herbicide
4,5,6,7-tetrachloro-2-trifluoromethylbenzimidazole[no description available]low00organochlorine compound
8-((4-chlorophenyl)thio)cyclic-3',5'-amp[no description available]low003',5'-cyclic purine nucleotide;
adenyl ribonucleotide;
aryl sulfide;
organochlorine compound		protein kinase agonist
3-(2,2-dichlorovinyl)-2,2-dimethylcyclopropane carboxylic acid[no description available]low00organochlorine compound
raiser[no description available]low00(trifluoromethyl)benzenes;
organochlorine compound;
pyrrolidines		agrochemical;
carotenoid biosynthesis inhibitor;
herbicide
quinclorac[no description available]low00monocarboxylic acid;
organochlorine compound;
quinolinemonocarboxylic acid		agrochemical;
herbicide;
synthetic auxin
dimethenamid[no description available]low00aromatic amide;
ether;
organochlorine compound;
thiophenes
fluxofenim[no description available]low00organochlorine compound
clodinafop-propargyl[no description available]low00aromatic ether;
carboxylic ester;
organochlorine compound;
organofluorine compound;
propyzamide;
pyridines		agrochemical;
EC 6.4.1.2 (acetyl-CoA carboxylase) inhibitor;
herbicide
3-chlorolactate[no description available]low002-hydroxy monocarboxylic acid;
organochlorine compound
cloquintocet-mexyl[no description available]low00aromatic ether;
carboxylic ester;
organochlorine compound;
quinolines
2,6-dichloroisonicotinic acid[no description available]low00monocarboxylic acid;
organochlorine compound;
pyridines		EC 1.11.1.11 (L-ascorbate peroxidase) inhibitor
sporidesmin[no description available]low00aromatic ether;
cyclic ketone;
diketone;
organic disulfide;
organic heteropentacyclic compound;
organochlorine compound;
secondary alcohol;
tertiary alcohol;
tertiary amino compound		mycotoxin;
Wnt signalling activator
4-hydroxycyclophosphamide[no description available]low00nitrogen mustard;
organochlorine compound;
phosphorodiamide		alkylating agent;
metabolite
fotemustine[no description available]low00N-nitrosoureas;
organic phosphonate;
organochlorine compound
cyfluthrin[no description available]low00aromatic ether;
cyclopropanecarboxylate ester;
nitrile;
organochlorine compound;
organofluorine compound		agrochemical;
pyrethroid ester insecticide
1-hydroxymethylmidazolam[no description available]low00aromatic primary alcohol;
imidazobenzodiazepine;
monofluorobenzenes;
organochlorine compound		drug metabolite;
human blood serum metabolite;
human urinary metabolite
exp3174[no description available]low00biphenylyltetrazole;
imidazoles;
organochlorine compound		metabolite
florfenicol[no description available]low00organochlorine compound;
organofluorine compound;
secondary alcohol;
secondary carboxamide;
sulfone		antimicrobial agent
monochlorobimane[no description available]low00organochlorine compound;
pyrazolopyrazole		fluorochrome
Prothioconazole-desthio[no description available]low00organochlorine compound
saclofen[no description available]low00organochlorine compound
piperaquine[no description available]low00aminoquinoline;
N-arylpiperazine;
organochlorine compound		antimalarial
mk 0663[no description available]low00bipyridines;
organochlorine compound;
sulfone		cyclooxygenase 2 inhibitor;
non-steroidal anti-inflammatory drug
norketamine[no description available]low00organochlorine compound
7,8-dichloro-1,2,3,4-tetrahydroisoquinoline[no description available]low00isoquinolines;
organochlorine compound
4-hydroxymidazolam[no description available]low00imidazobenzodiazepine;
monofluorobenzenes;
organic hydroxy compound;
organochlorine compound		drug metabolite;
human blood serum metabolite;
human urinary metabolite
cki 7[no description available]low00isoquinolines;
organochlorine compound;
primary amino compound;
sulfonamide		EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor
6-bromo-3-(bromomethyl)-7-methyl-2,3,7-trichloro-1-octene[no description available]low00monoterpenoid;
organobromine compound;
organochlorine compound		algal metabolite;
antineoplastic agent;
marine metabolite
pyrrolomycin a[no description available]low00antibiotic antifungal agent;
C-nitro compound;
organochlorine compound;
pyrroles		antibacterial agent;
bacterial metabolite
sk&f 83959[no description available]low00benzazepine;
catechols;
organochlorine compound;
tertiary amino compound		dopamine agonist
1-hydroxymethylmidazolam glucuronide[no description available]low00beta-D-glucosiduronic acid;
imidazobenzodiazepine;
monofluorobenzenes;
monosaccharide derivative;
organochlorine compound		drug metabolite;
human blood serum metabolite;
human urinary metabolite
cox 189[no description available]low00amino acid;
monocarboxylic acid;
organochlorine compound;
organofluorine compound;
secondary amino compound		cyclooxygenase 2 inhibitor;
non-steroidal anti-inflammatory drug
pannarin[no description available]low00aldehyde;
aromatic ether;
depsidones;
organic heterotricyclic compound;
organochlorine compound;
phenols		antimicrobial agent;
antineoplastic agent;
apoptosis inducer;
lichen metabolite
5,6-dehydronorketamine[no description available]low00organochlorine compound
6-chloro-3,5-diaminopyrazine-3-carboxamide[no description available]low00organochlorine compound;
pyrazines
quizalofop[no description available]low00aromatic ether;
monocarboxylic acid;
organochlorine compound;
quinoxaline derivative
chloroorienticin b[no description available]low00cyclic ether;
glycopeptide;
heterodetic cyclic peptide;
monosaccharide derivative;
organochlorine compound;
polyphenol		antimicrobial agent;
bacterial metabolite
lapatinib[no description available]low00furans;
organochlorine compound;
organofluorine compound;
quinazolines		antineoplastic agent;
tyrosine kinase inhibitor
cimicoxib[no description available]low00aromatic ether;
imidazoles;
organochlorine compound;
organofluorine compound;
sulfonamide		cyclooxygenase 2 inhibitor;
non-steroidal anti-inflammatory drug
n-(3-chloro-7-indolyl)-1,4-benzenedisulphonamide[no description available]low00chloroindole;
organochlorine compound;
sulfonamide		antineoplastic agent;
EC 4.2.1.1 (carbonic anhydrase) inhibitor
acivicin[no description available]low00isoxazoles;
non-proteinogenic L-alpha-amino acid;
organochlorine compound		antileishmanial agent;
antimetabolite;
antimicrobial agent;
antineoplastic agent;
EC 2.3.2.2 (gamma-glutamyltransferase) inhibitor;
glutamine antagonist;
metabolite
mometasone furoate[no description available]low0011beta-hydroxy steroid;
2-furoate ester;
20-oxo steroid;
3-oxo-Delta(1),Delta(4)-steroid;
organochlorine compound;
steroid ester		anti-allergic agent;
anti-inflammatory drug
ochratoxin a[no description available]low00isochromanes;
monocarboxylic acid amide;
N-acyl-L-phenylalanine;
organochlorine compound;
phenylalanine derivative		Aspergillus metabolite;
calcium channel blocker;
carcinogenic agent;
mycotoxin;
nephrotoxin;
Penicillium metabolite;
teratogenic agent
chlorpromazine n-oxide[no description available]low00organochlorine compound;
phenothiazines;
tertiary amine oxide		metabolite
loteprednol etabonate[no description available]low0011beta-hydroxy steroid;
3-oxo-Delta(1),Delta(4)-steroid;
etabonate ester;
organochlorine compound;
steroid acid ester;
steroid ester		anti-inflammatory drug
bromochloroacetic acid[no description available]low002-bromocarboxylic acid;
monocarboxylic acid;
organochlorine compound
tolfenamic acid[no description available]low00aminobenzoic acid;
organochlorine compound;
secondary amino compound		EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
EC 2.7.1.33 (pantothenate kinase) inhibitor;
non-narcotic analgesic;
non-steroidal anti-inflammatory drug
1,4-dichloro-2-butene[no description available]low00organochlorine compound
1-(4-chlorophenyl)-1-cyclohexyl-3-(4-morpholinyl)-1-propanol[no description available]low00organochlorine compound
2-[(3-chlorophenyl)-(3-oxo-5-propyl-1,2-dihydropyrazol-4-yl)methyl]propanedinitrile[no description available]low00organochlorine compound
1-piperidinecarboxylic acid (5-chloro-8-quinolinyl) ester[no description available]low00organochlorine compound;
quinolines
transfluthrin[no description available]low00carboxylic ester;
cyclopropanes;
organochlorine compound;
organofluorine compound		pyrethroid ester insecticide
tram 34[no description available]low00organochlorine compound
N-(2-chlorophenyl)hydrazine-1-carbothioamide[no description available]low00organochlorine compound
3-pyridinecarboxylic acid (5-chloro-8-quinolinyl) ester[no description available]low00organochlorine compound;
quinolines
CHIC-35[no description available]low00aromatic compound;
organic heterotricyclic compound;
organochlorine compound;
primary carboxamide		EC 3.5.1.98 (histone deacetylase) inhibitor
3-(2-chlorophenyl)-5-methyl-N-(5-propan-2-yl-1,3,4-thiadiazol-2-yl)-4-isoxazolecarboxamide[no description available]low00organochlorine compound
4-chloro-N-(4-chloro-2-methylphenyl)-5-dithiazolimine[no description available]low00organochlorine compound
1-[(7-chloro-4-quinolinyl)amino]-3-(2,4-dichlorophenyl)thiourea[no description available]low00organochlorine compound;
quinolines
2-chloro-N-[3-[(2-chlorophenyl)methyl]-2-thiazolylidene]acetamide[no description available]low00organochlorine compound
2-(4-chlorophenyl)guanidine[no description available]low00organochlorine compound
2-(4-chlorophenyl)-6-(methylthio)-4-oxo-2,3-dihydro-1,3-thiazine-5-carbonitrile[no description available]low00organochlorine compound
N-(4-chlorophenethyl)-N'-(4-chlorophenyl)urea[no description available]low00organochlorine compound
6-amino-4-(3-chlorophenyl)-3-methyl-1-(phenylmethyl)-4H-pyrano[2,3-c]pyrazole-5-carbonitrile[no description available]low00organochlorine compound;
pyranopyrazole
5-chloro-7-[3-pyridinyl-(2-pyridinylamino)methyl]-8-quinolinol[no description available]low00organochlorine compound;
quinolines
cb 7969312[no description available]low00organochlorine compound;
quinolines
ospemifene[no description available]low00aromatic ether;
organochlorine compound;
primary alcohol		anti-inflammatory agent;
antineoplastic agent;
estrogen receptor modulator
dasatinib[no description available]low001,3-thiazoles;
aminopyrimidine;
monocarboxylic acid amide;
N-(2-hydroxyethyl)piperazine;
N-arylpiperazine;
organochlorine compound;
secondary amino compound;
tertiary amino compound		anticoronaviral agent;
antineoplastic agent;
tyrosine kinase inhibitor
N-[(4-chlorophenyl)methyl]-3-(1-ethyl-5-methyl-4-pyrazolyl)-4,5-dihydroisoxazole-5-carboxamide[no description available]low00organochlorine compound
4-butyl-3-(4-chloro-1,5-dimethyl-3-pyrazolyl)-1H-1,2,4-triazole-5-thione[no description available]low00organochlorine compound
quinoxyfen[no description available]low00aromatic ether;
monofluorobenzenes;
organochlorine compound;
quinolines		antifungal agrochemical
5-chloro-7-[1-piperidinyl(2-pyridinyl)methyl]-8-quinolinol[no description available]low00organochlorine compound;
quinolines
5-chloro-7-[(4-ethyl-1-piperazinyl)-(3-pyridinyl)methyl]-8-quinolinol[no description available]low00organochlorine compound;
quinolines
ML162[no description available]low00monochlorobenzenes;
monomethoxybenzene;
organochlorine compound;
secondary carboxamide;
tertiary carboxamide;
thiophenes		EC 1.11.1.9 (glutathione peroxidase) inhibitor;
ferroptosis inducer
epi 001[no description available]low00diether;
organochlorine compound		androgen antagonist
3-[(3-chlorophenyl)methylthio]-N-cyclopentylpropanamide[no description available]low00organochlorine compound
5-[3-(2-chloro-6-methoxy-3-quinolinyl)-5-(2-furanyl)-3,4-dihydropyrazol-2-yl]-5-oxopentanoic acid[no description available]low00organochlorine compound;
quinolines
[3-(2-chloro-6-ethoxy-3-quinolinyl)-5-phenyl-3,4-dihydropyrazol-2-yl]-thiophen-2-ylmethanone[no description available]low00organochlorine compound;
quinolines
4-chloro-N-(1,3,4-thiadiazol-2-yl)-5-dithiazolimine[no description available]low00organochlorine compound
[4-(4-chlorophenyl)-4,5-dihydro-1H-pyrazol-3-yl]-(2-oxiranyl)methanone[no description available]low00organochlorine compound
clodronic acid[no description available]low00organochlorine compound
ex 527[no description available]low00carbazoles;
monocarboxylic acid amide;
organochlorine compound
ro 60-0175[no description available]low00indoles;
organochlorine compound;
organofluorine compound;
primary amino compound
maytansine[no description available]low00alpha-amino acid ester;
carbamate ester;
epoxide;
maytansinoid;
organic heterotetracyclic compound;
organochlorine compound		antimicrobial agent;
antimitotic;
antineoplastic agent;
plant metabolite;
tubulin modulator
cyhalothrin[no description available]low00aromatic ether;
cyclopropanecarboxylate ester;
nitrile;
organochlorine compound;
organofluorine compound		agrochemical;
pyrethroid ester acaricide;
pyrethroid ester insecticide
arachidonyl-2-chloroethylamide[no description available]low00fatty amide;
organochlorine compound;
secondary carboxamide;
synthetic cannabinoid		CB1 receptor agonist;
CB2 receptor agonist;
neuroprotective agent
nostocarboline[no description available]low00alkaloid;
beta-carbolines;
organic cation;
organochlorine compound		antimalarial;
EC 3.1.1.8 (cholinesterase) inhibitor;
metabolite
su 11652[no description available]low00olefinic compound;
organochlorine compound;
oxindoles;
pyrrolecarboxamide;
tertiary amino compound		EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor;
EC 3.1.4.12 (sphingomyelin phosphodiesterase) inhibitor
chlorferron[no description available]low00organochlorine compound
2-amino-6-chloropurine[no description available]low002-aminopurines;
organochlorine compound
clodinafop[no description available]low00aromatic ether;
monocarboxylic acid;
organochlorine compound;
organofluorine compound;
pyridines		EC 6.4.1.2 (acetyl-CoA carboxylase) inhibitor;
phenoxy herbicide
salubrinal[no description available]low00aminal;
organochlorine compound;
quinolines;
secondary carboxamide;
thioureas
picloxydine[no description available]low00organochlorine compound
ma-1[no description available]low00carboxamidine;
organochlorine compound;
pyrimidone;
pyrrolidines		antineoplastic agent;
EC 2.4.2.4 (thymidine phosphorylase) inhibitor
bifenthrin[no description available]low00carboxylic ester;
cyclopropanecarboxylate ester;
cyclopropanes;
organochlorine compound;
organofluorine compound		pyrethroid ester acaricide;
pyrethroid ester insecticide
chaetoviridin a[no description available]low00azaphilone;
beta-hydroxy ketone;
enone;
gamma-lactone;
organic heterotricyclic compound;
organochlorine compound;
secondary alcohol		antifungal agent;
Chaetomium metabolite
su 5614[no description available]low00organochlorine compound;
oxindoles;
pyrroles		vascular endothelial growth factor receptor antagonist
bay 12-9566[no description available]low00biphenyls;
organochlorine compound
rwj-333369[no description available]low00organochlorine compound
2-[3-(3-chlorophenyl)-5-isoxazolyl]-1-hydroxy-4H-1,2,4-benzotriazin-3-one[no description available]low00organochlorine compound
nsc 716970[no description available]low00aromatic amine;
aromatic ether;
indolecarboxamide;
organochlorine compound		antineoplastic agent
lonafarnib[no description available]low00benzocycloheptapyridine;
heteroarylpiperidine;
N-acylpiperidine;
organobromine compound;
organochlorine compound;
ureas
cangrelor[no description available]low00adenosine 5'-phosphate;
aryl sulfide;
nucleoside triphosphate analogue;
organochlorine compound;
organofluorine compound;
secondary amino compound		P2Y12 receptor antagonist;
platelet aggregation inhibitor
cyazofamid[no description available]low00imidazole fungicide;
imidazoles;
nitrile;
organochlorine compound;
sulfamides;
sulfonamide fungicide		antifungal agrochemical;
mitochondrial cytochrome-bc1 complex inhibitor
avanafil[no description available]low00aromatic amide;
monocarboxylic acid amide;
organochlorine compound;
prolinols;
pyrimidines		EC 3.1.4.* (phosphoric diester hydrolase) inhibitor;
vasodilator agent
rivaroxaban[no description available]low00aromatic amide;
lactam;
monocarboxylic acid amide;
morpholines;
organochlorine compound;
oxazolidinone;
thiophenes		anticoagulant;
EC 3.4.21.6 (coagulation factor Xa) inhibitor
estin[no description available]low001-benzofurans;
ether;
methyl ester;
organochlorine compound;
oxaspiro compound;
phenols		Aspergillus metabolite;
Penicillium metabolite
pitolisant[no description available]low00organochlorine compound
dysidenin[no description available]low001,3-thiazoles;
organochlorine compound;
secondary carboxamide;
tertiary carboxamide		animal metabolite;
marine metabolite;
toxin
6-chlorotryptophan[no description available]low00L-alpha-amino acid zwitterion;
L-tryptophan derivative;
non-proteinogenic L-alpha-amino acid;
organochlorine compound
tolfenpyrad[no description available]low00aromatic amide;
aromatic ether;
organochlorine compound;
pyrazole insecticide		agrochemical;
antifungal agent;
EC 1.3.5.1 [succinate dehydrogenase (quinone)] inhibitor;
mitochondrial NADH:ubiquinone reductase inhibitor
saracatinib[no description available]low00aromatic ether;
benzodioxoles;
diether;
N-methylpiperazine;
organochlorine compound;
oxanes;
quinazolines;
secondary amino compound		anticoronaviral agent;
antineoplastic agent;
apoptosis inducer;
autophagy inducer;
EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor;
radiosensitizing agent
marizomib[no description available]low00beta-lactone;
gamma-lactam;
organic heterobicyclic compound;
organochlorine compound;
salinosporamide		antineoplastic agent;
proteasome inhibitor
cyantraniliprole[no description available]low00nitrile;
organobromine compound;
organochlorine compound;
pyrazole insecticide;
pyridines;
secondary carboxamide		ryanodine receptor agonist
lorcaserin[no description available]low00benzazepine;
organochlorine compound		anti-obesity agent;
appetite depressant
3-(4-chlorophenyl)-adamantane-1-carboxylic acid (pyridin-4-ylmethyl)amide[no description available]low00organochlorine compound
N-[(2-chlorophenyl)methyl]-2-(4-ethyl-1-oxo-2-pyrrolo[1,2-d][1,2,4]triazinyl)acetamide[no description available]low00organochlorine compound
complestatin[no description available]low00cyclic ether;
heterodetic cyclic peptide;
indoles;
organic heterobicyclic compound;
organochlorine compound;
peptide antibiotic;
polyphenol		anti-HIV-1 agent;
antimicrobial agent;
HIV-1 integrase inhibitor;
metabolite
neuroprotectin a[no description available]low00cyclic ether;
heterodetic cyclic peptide;
indoles;
organochlorine compound;
polyphenol		HIV-1 integrase inhibitor;
metabolite
cnf 2024[no description available]low002-aminopurines;
aromatic ether;
organochlorine compound;
pyridines		antineoplastic agent;
Hsp90 inhibitor
4'-epichaetoviridin A[no description available]low00azaphilone;
beta-hydroxy ketone;
enone;
gamma-lactone;
organic heterotricyclic compound;
organochlorine compound;
secondary alcohol		Chaetomium metabolite
plx 4720[no description available]low00aromatic ketone;
difluorobenzene;
organochlorine compound;
pyrrolopyridine;
sulfonamide		antineoplastic agent;
B-Raf inhibitor
N-[3-(3-chlorophenyl)phenyl]-1-(3-isoxazolylmethyl)-4-piperidinecarboxamide[no description available]low00biphenyls;
organochlorine compound
N-[3-(3-chlorophenyl)phenyl]-1-(3-oxolanylmethyl)-4-piperidinecarboxamide[no description available]low00biphenyls;
organochlorine compound
marinopyrrole a[no description available]low00aromatic ketone;
organochlorine compound;
phenols;
pyrroles		antibacterial agent;
antimicrobial agent;
antineoplastic agent;
bacterial metabolite;
marine metabolite
suvorexant[no description available]low001,3-benzoxazoles;
aromatic amide;
diazepine;
organochlorine compound;
triazoles		central nervous system depressant;
orexin receptor antagonist
chaetoviridin E[no description available]low00azaphilone;
enone;
gamma-lactone;
organic heterotricyclic compound;
organochlorine compound		Chaetomium metabolite
pexidartinib[no description available]low00aminopyridine;
organochlorine compound;
organofluorine compound;
pyrrolopyridine;
secondary amino compound		antineoplastic agent;
EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor
4-chloro-N-(5-methyl-1,3,4-oxadiazol-2-yl)-5-dithiazolimine[no description available]low00organochlorine compound
thiopental sodium[no description available]low00organochlorine compound;
piperazines;
pyrimidines		antineoplastic agent;
tyrosine kinase inhibitor
jq1 compound[no description available]low00carboxylic ester;
organochlorine compound;
tert-butyl ester;
thienotriazolodiazepine		angiogenesis inhibitor;
anti-inflammatory agent;
antineoplastic agent;
apoptosis inducer;
bromodomain-containing protein 4 inhibitor;
cardioprotective agent;
ferroptosis inducer
N-[9-(dichloromethylene)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-3-(difluoromethyl)-1-methylpyrazole-4-carboxamide[no description available]low00aromatic amide;
bridged compound;
olefinic compound;
organochlorine compound;
organofluorine compound;
pyrazoles
AZD3463[no description available]low00aminopiperidine;
aminopyrimidine;
indoles;
monomethoxybenzene;
organochlorine compound;
secondary amino compound;
tertiary amino compound		antineoplastic agent;
apoptosis inducer;
autophagy inducer;
EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor
ceritinib[no description available]low00aminopyrimidine;
aromatic ether;
organochlorine compound;
piperidines;
secondary amino compound;
sulfone		antineoplastic agent;
EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor
HG-10-102-01[no description available]low00aminopyrimidine;
aromatic ether;
monocarboxylic acid amide;
morpholines;
organochlorine compound;
secondary amino compound		EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor
opt 80[no description available]low00carboxylic ester;
glycoside;
macrolide antibiotic;
organochlorine compound;
phenols		antibacterial drug;
bacterial metabolite;
EC 2.7.7.6 (RNA polymerase) inhibitor
acarbose[no description available]low00chondramide;
indoles;
organochlorine compound;
phenols		antineoplastic agent;
bacterial metabolite
THZ531[no description available]low00aminopyrimidine;
enamide;
indoles;
N-acylpiperidine;
organochlorine compound;
secondary amino compound;
secondary carboxamide		antineoplastic agent;
apoptosis inducer;
EC 2.7.11.22 (cyclin-dependent kinase) inhibitor
norclozapine[no description available]low00dibenzodiazepine;
organochlorine compound;
piperazines		delta-opioid receptor agonist;
metabolite;
serotonergic antagonist
5-[1-[(2-chlorophenyl)methyl]-2,5-dimethyl-3-pyrrolyl]-N-(1-methoxypropan-2-yl)-6H-1,3,4-thiadiazin-2-amine[no description available]low00organochlorine compound
8-((4-chlorophenyl)thio)cyclic-3',5'-gmp[no description available]low003',5'-cyclic purine nucleotide;
aryl sulfide;
organochlorine compound;
ribonucleotide		protein kinase agonist
XL413[no description available]low00benzofuropyrimidine;
organochlorine compound;
pyrrolidines		antineoplastic agent;
EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor
kethoxal[no description available]low00aldehyde hydrate;
butanone		antiinfective agent
methylene glycol[no description available]low00aldehyde hydrate;
methanediols;
one-carbon compound
ConditionIndicatedRelationship StrengthStudiesTrials
47,XX,+210low10
47,XY,+210low10
A-V Dissociation0low10
Abdomen, Acute0low20
Abdominal Cramps0low10
Abdominal Cryptorchidism0low10
Abdominal Injuries0low10
Abdominal Migraine0medium134
Abnormal Deep Tendon Reflex0medium31
Abnormal Reflex0medium31
Abnormal Reflexes0medium31
Abnormalities, Autosome0low120
Abnormalities, Chromosomal0low120
Abnormalities, Chromosome0low120
Abnormalities, Congenital, Nervous System0low10
Abnormalities, Drug-Induced0low20
Abnormalities, Nervous System0low10
Abnormality, Heart0medium101
Abnormality, Torsion0low10
Abortion, Septic0low10
Abortion, Veterinary0low20
Abscess, Hepatic0low10
Absence Seizure0medium382
Absence Seizure Disorder0low20
Absence Seizures0medium382
Absence Status0low80
Abstinence Syndrome, Neonatal0medium21
Academic Disorder, Developmental0low10
Acathisia, Drug-Induced0low20
Ache0medium122
Achondroplasia0low10
Achondroplasia, Severe, With Developmental Delay And Acanthosis Nigricans0low10
Acid Aspiration Syndrome0low10
Acidosis, Lactic0medium21
Acidosis, Respiratory0low10
Acne0medium11
Acne Vulgaris0medium11
Acquired Laryngeal Stenosis0low10
Acquired Metabolic Diseases, Brain0low10
Acquired Metabolic Diseases, Nervous System0low10
Acquired Metabolic Encephalopathies0low10
Acquired Subglottic Stenosis0low10
Actinic Reticuloid Syndrome0low10
Action Tremor0medium32
Acute Brain Injuries0low40
Acute Confusional Migraine0medium134
Acute Confusional Senile Dementia0low20
Acute Disease0medium92
Acute Hypercapnic Respiratory Failure0low110
Acute Hypoxemic Respiratory Failure0low110
Acute Kidney Failure0low10
Acute Kidney Injury0low10
Acute Kidney Insufficiency0low10
Acute Liver Injury, Drug-Induced0low100
Acute Post-operative Pain0medium31
Acute Post-Traumatic Stress Disorder0medium11
Acute Postoperative Pain0medium31
Acute Renal Failure0low10
Acute Renal Injury0low10
Acute Renal Insufficiency0low10
ADDH0low10
Addiction, Opioid0medium11
Addison Disease0low10
Addison's Disease0low10
Adenoma0low10
Adenoma, Basal Cell0low10
Adenoma, Follicular0low10
Adenoma, Hepatocellular0low20
Adenoma, Liver Cell0low20
Adenoma, Microcystic0low10
Adenoma, Monomorphic0low10
Adenoma, Papillary0low10
Adenoma, Trabecular0low10
Adhesions, Tissue0low10
Adipocere0low40
Adjustment Disorder0medium11
Adjustment Disorders0medium11
Adult Learning Disabilities0low10
Adult Learning Disorders0low10
Adult-Onset Dystonias0low20
Adult-Onset Idiopathic Focal Dystonias0low20
Adult-Onset Idiopathic Torsion Dystonias0low20
Adverse Drug Event0low90
Adverse Drug Reaction0low90
Affective Psychosis, Bipolar0medium11
Aggression0low10
Aging0low60
Agitation, Psychomotor0medium51
Airway Obstruction0low40
Akathisia0medium51
Akathisia, Drug-Induced0low20
Akathisia, Tardive0low20
Akinetic Petit Mal0low20
Akinetic-Rigid Variant of Huntington Disease0low10
Alcohol Abuse0medium132
Alcohol Addiction0medium132
Alcohol Dependence0medium132
Alcohol Drinking0low60
Alcohol Use Disorder0medium132
Alcohol Withdrawal Associated Autonomic Hyperactivity0low20
Alcohol Withdrawal Delirium0low20
Alcohol Withdrawal Hallucinosis0low20
Alcohol Withdrawal-Induced Delirium Tremens0low20
Alcoholic Intoxication0low50
Alcoholic Intoxication, Chronic0medium132
Alcoholism0medium132
Algor Mortis0low40
Allergic Contact Dermatitis0low20
Allergic Reaction0low10
Allergy0low10
Allergy, Drug0medium91
Allergy, Food0low10
Allodynia0low10
Allodynia, Mechanical0low10
Allodynia, Tactile0low10
Allodynia, Thermal0low10
Alloxan Diabetes0low10
Alopecia0low20
Alopecia Cicatrisata0low20
Alopecia, Androgenetic0low20
Alopecia, Male Pattern0low20
Alzheimer Dementia0low20
Alzheimer Disease0low20
Alzheimer Disease, Early Onset0low20
Alzheimer Disease, Late Onset0low20
Alzheimer Sclerosis0low20
Alzheimer Syndrome0low20
Alzheimer Type Senile Dementia0low20
Alzheimer-Type Dementia (ATD)0low20
Alzheimer's Disease0low20
Alzheimer's Disease, Focal Onset0low20
Alzheimer's Diseases0low20
Amblyopia0low20
Amblyopia, Developmental0low20
Amblyopia, Stimulus Deprivation-Induced0low20
Amblyopia, Suppression0low20
Amentia0medium21
Amnesia0low10
Amnesia-Memory Loss0low10
Amnesia, Dissociative0low10
Amnesia, Global0low10
Amnesia, Hysterical0low10
Amnesia, Tactile0low10
Amnesia, Temporary0low10
Amnestic State0low10
Amyotrophic Neuralgia0low10
Amyotrophy, Hereditary Neuralgic0low10
Amyotrophy, Hereditary Neuralgic, with Predilection for Brachial Plexus0low10
Amyotrophy, Neuralgic0low10
Anaphylactic Reaction0low60
Anaphylactoid Reaction0low60
Anaphylactoid Shock0low60
Anaphylaxis0low60
Anasarca0low10
Androgenetic Alopecia0low20
Androgenic Alopecia0low20
Anesthesia0low1310
Anesthesia Awareness0low10
Aneuploid0low270
Aneuploid Cell0low270
Aneuploidy0low270
Anisometropic Amblyopia0low20
Anniversary Reaction0medium11
Anochlesia0low10
Anomalies, Nervous System0low10
Anoxemia0low130
Anoxia0low130
Anoxia, Brain0medium31
Anoxia, Cerebral0medium31
Anoxic Brain Damage0medium31
Anoxic Encephalopathy0medium31
ANS (Autonomic Nervous System) Diseases0low10
ANS Diseases0low10
Anterior Choroidal Artery Infarction0low40
Anterior Circulation Transient Ischemic Attack0low50
Antibody Deficiency Syndrome0low10
Anxiety Disorders0medium31
Anxiety Neuroses0medium31
Anxiety States, Neurotic0medium31
Apnea0low20
Apnea, Obstructive Sleep0low10
Apnea, Sleep0low40
Apoplexy0low30
Aqueductal Stenosis0low10
Arm Injuries0low10
Arrhythmia0low230
Arrhythmias, Cardiac0low230
Arrythmia0low230
Arsenic Encephalopathy0low10
Arsenic Induced Polyneuropathy0low10
Arsenic Poisoning0low10
Arsenic Poisoning, Inorganic0low10
Arsenic Poisoning, Nervous System0low10
Arsenic Poisoning, Organic0low10
Arteriosclerosis0low20
Arthritis, Rheumatoid0low10
Ascorbic Acid Deficiency0low10
Asialia0medium11
Asphyxia0low10
Asphyxia Neonatorum0medium11
Aspiration Pneumonia0low10
Asthma0medium71
Asthma, Bronchial0medium71
Asthmatic Crisis0low10
Asthmatic Shock0low10
Asystole0low40
Atelectasis0low10
Atelectasis, Congestive0low10
Atherogenesis0low10
Atherosclerosis0low10
Atherosclerotic Parkinsonism0low30
Atonic Absence Seizure0medium382
Atonic Absence Seizures0medium382
Atonic Seizure0medium382
Atonic Seizures0medium382
Atopic Hypersensitivity0low10
Atrial Fibrillation0low20
Atrioventricular Dissociation0low10
Atrioventricular Nodal Re-Entrant Tachycardia0low10
Atrioventricular Reentrant Tachycardia0low10
Atrophy0low10
Attention Deficit Disorder0low10
Attention Deficit Disorder with Hyperactivity0low10
Attention Deficit Disorders with Hyperactivity0low10
Attention Deficit Hyperactivity Disorder0low10
Attention Deficit Hyperactivity Disorders0low10
Attention Deficit-Hyperactivity Disorder0low10
Auditory Cortex Disorder0low10
Auditory Diseases, Central0low10
Auditory Dysfunction, Central0low10
Auditory Hyperesthesia0low10
Auditory Pathway Disorders, Central0low10
Auditory Processing Disorder, Central0low10
Aura0medium211
Auricular Fibrillation0low20
Auriculo-Ventricular Dissociation0low10
Autism0low30
Autism Spectrum Disorder0low20
Autism Spectrum Disorders0low20
Autism, Early Infantile0low30
Autism, Infantile0low30
Autistic Disorder0low30
Autistic Spectrum Disorder0low20
Autoimmune Diabetes0low10
Autoimmune Disease0low10
Autoimmune Diseases0low10
Autonomic Central Nervous System Diseases0low10
Autonomic Diseases0low10
Autonomic Hyperactivity, Alcohol Withdrawal Associated0low20
Autonomic Nervous System Diseases0low10
Autonomic Nervous System Disorders0low10
Autonomic Peripheral Nervous System Diseases0low10
Autosomal Dominant Familial Dystonia0low20
Autosomal Recessive Familial Dystonia0low20
Autosome Abnormalities0low120
Awakening Epilepsy0medium211
Awareness During Anesthesia0low10
Baldness0low20
Baldness, Male Pattern0low20
Baltic Myoclonic Epilepsy0low10
Baltic Myoclonus0low10
Baltic Myoclonus Epilepsy0low10
Barotrauma0low10
Behavior Disorders0medium134
Bends0low10
Benign Infantile Myoclonic Epilepsy0low10
Benign Neoplasms0low90
Benign Neoplasms, Brain0low10
Benign Psychomotor Epilepsy, Childhood0low20
Bertielliasis0low10
Beuren Syndrome0low10
Bewilderment0low10
Bilateral Cryptorchidism0low10
Bilateral Headache0low10
Bilharziasis0low10
Bilirubinemia0low10
Bipolar Disorder0medium11
Bipolar Mood Disorder0medium11
Birth Injuries0low20
Birth Weight0low40
Bleeding0medium31
Blood Coagulation Disorders0low10
Blood Poisoning0low10
Blood Pressure, High0low30
Blood Pressure, Low0medium91
Bloodstream Infection0low10
Body Weight0medium212
Bordetella pertussis Infection, Respiratory0low10
Bouillaud Disease0low10
Bouillaud's Disease0low10
Bovine Diseases0low50
Brachial Neuralgia0low10
Brachial Neuritis0low10
Brachial Plexus Neuritis0low10
Brachial Plexus Neuropathy, Hereditary0low10
Bradyarrhythmia0low60
Bradyarrhythmias0low60
Bradycardia0low60
Brain Anoxia0medium31
Brain Cancer0low10
Brain Concussion0low10
Brain Damage, Chronic0low30
Brain Diseases, Metabolic0low10
Brain Diseases, Metabolic, Acquired0low10
Brain Disorders0medium111
Brain Disorders, Metabolic0low10
Brain Disorders, Metabolic, Acquired0low10
Brain Dysfunction, Minimal0low10
Brain Edema0low20
Brain Emboli0low10
Brain Embolism0low10
Brain Embolism and Thrombosis0low10
Brain Hemorrhage, Cerebral0low30
Brain Hypoxia0medium31
Brain Inflammation0low10
Brain Injuries0low40
Brain Injuries, Acute0low40
Brain Injuries, Focal0low40
Brain Ischemia0low100
Brain Lacerations0low40
Brain Metastases0low10
Brain Neoplasm, Primary0low10
Brain Neoplasms0low10
Brain Neoplasms, Benign0low10
Brain Neoplasms, Malignant0low10
Brain Neoplasms, Malignant, Primary0low10
Brain Neoplasms, Primary Malignant0low10
Brain Stem Ischemia, Transient0low50
Brain Stem Transient Ischemic Attack0low50
Brain Swelling0low20
Brain Syndrome, Metabolic0low10
Brain Syndrome, Metabolic, Acquired0low10
Brain TIA0low50
Brain Tumor, Primary0low10
Brain Tumor, Recurrent0low10
Brain Tumors0low10
Brainstem Ischemia, Transient0low50
Brainstem Transient Ischemic Attack0low50
Breathing Sounds0low20
Breathlessness0low20
Bronchial Asthma0medium71
Bronchial Pneumonia0low10
Bronchiolitis, Viral0low20
Bronchitis0low20
Bronchopneumonia0low10
Bronchopulmonary Dysplasia0low20
Brugada ECG Pattern0low10
Brugada Syndrome0low10
Brugada Syndrome 10low10
Brugada Type ECG Pattern0low10
Bruise0low10
Bulbocavernosus Reflex, Decreased0medium31
Bulbocavernousus Reflex Absent0medium31
Burns0medium11
Burns, Chemical0low20
Cadaver0low10
Caisson Disease0low10
Cancer0low90
Cancer of Brain0low10
Cancer of Colon0low20
Cancer of Kidney0low10
Cancer of Liver0low40
Cancer of Lung0low10
Cancer of Pituitary0low10
Cancer of the Brain0low10
Cancer of the Colon0low20
Cancer of the Kidney0low10
Cancer of the Liver0low40
Cancer of the Lung0low10
Cancer of the Pituitary0low10
Cancer, Hepatocellular0low40
Canine Diseases0low20
Cannabis Abuse0low10
Cannabis Dependence0low10
Cannabis-Related Disorder0low10
Carbon Monoxide Poisoning0low10
Carbon Tetrachloride Poisoning0low20
Carcinoma 256, Walker0low10
Carcinoma, Ehrlich Tumor0low10
Carcinoma, Hepatocellular0low20
Carcinosarcoma 256, Walker0low10
Cardiac Arrest0low40
Cardiac Arrhythmia0low230
Cardiac Arrhythmias0low230
Cardiac Complex, Premature0low10
Cardiac Complexes, Premature0low10
Cardiac Conduction Defect0low10
Cardiac Conduction Defects0low10
Cardiac Conduction System Disease0low10
Cardiac Conduction System Diseases0low10
Cardiac Diseases0medium41
Cardiac Disorders0medium41
Cardiac Dysrhythmia0low230
Cardiac Failure0low40
Cardiac Toxicity0low10
Cardiopulmonary Arrest0low40
Cardiotoxicity0low10
Cardiovascular Diseases0low30
Cardiovascular Stroke0medium82
Carditis0low10
Caries, Dental0low10
Carious Dentin0low10
Carious Lesions0low10
Carotid Circulation Transient Ischemic Attack0low50
Cat Diseases0low10
Catalepsy0low10
Cataract0medium72
Cataract, Membranous0medium72
Catatonia0low10
Catatonia, Malignant0low10
Catatonia, Organic0low10
Catatonic Rigidity0low10
Cattle Diseases0low50
CCl4 Poisoning0low20
Cell Transformation, Neoplastic0low10
Central Auditory Diseases0low10
Central Auditory Pathway Disorders0low10
Central Auditory Processing Disorder0low10
Central Autonomic Nervous System Diseases0low10
Central Hypothyroidism0low10
Central Nervous System Disease0low10
Central Nervous System Diseases0low10
Central Nervous System Disorder0low10
Central Nervous System Disorders0low10
Central Nervous System Disorders, Intracranial0medium111
Central Nervous System Intracranial Disorders0medium111
Central Nervous System Metabolic Disorders0low10
Centrala nervsystemets sjukdomar@sv0low10
Cenuriasis0low10
Cephalalgia0low10
Cephalgia0low10
Cephalgia, Vascular0low10
Cephalodynia0low10
Cerea Flexibilitas0low10
Cerebral Anoxia0medium31
Cerebral Arteriosclerosis0medium21
Cerebral Atherosclerosis0medium21
Cerebral Concussion0low10
Cerebral Edema0low20
Cerebral Edema, Cytotoxic0low20
Cerebral Edema, Vasogenic0low20
Cerebral Emboli0low10
Cerebral Embolism0low10
Cerebral Embolism and Thrombosis0low10
Cerebral Hemorrhage0low30
Cerebral Hypoxia0medium31
Cerebral Infarct0low40
Cerebral Infarction0low40
Cerebral Infarction, Left Hemisphere0low40
Cerebral Infarction, Middle Cerebral Artery0low20
Cerebral Infarction, Right Hemisphere0low40
Cerebral Ischemia0low100
Cerebral Ischemia, Transient0low50
Cerebral Parenchymal Hemorrhage0low30
Cerebral Stroke0low30
Cerebral Ventriculomegaly0low10
Cerebral, Left Hemisphere, Infarction0low40
Cerebral, Right Hemisphere, Infarction0low40
Cerebromeningitis0low10
Cerebrovascular Accident0low30
Cerebrovascular Accident, Acute0low30
Cerebrovascular Apoplexy0low30
Cerebrovascular Stroke0low30
Cervical Migraine Syndrome0medium134
Cervico-Brachial Neuralgia0low10
Cervicobrachial Neuralgia0low10
Cestode Infections0low10
Chemical and Drug Induced Liver Injury0low100
Chemical Burns0low20
Chemical Dependence0low210
Chemically-Induced Liver Toxicity0low100
Child Behavior Disorders0medium31
Child Development Deviations0low10
Child Development Disorders0low10
Child Development Disorders, Specific0low10
Childhood Absence Epilepsy0low20
Childhood Behavior Disorders0medium31
Childhood Benign Psychomotor Epilepsy0low20
Childhood Onset Dystonias0low20
Childhood Schizophrenia0medium11
Childhood Torsion Disease0low10
Childhood-Onset Schizophrenia0medium11
Choking0low40
Cholera0low10
Chorea, Chronic Progressive Hereditary (Huntington)0low10
Choroby OUN@pl0low10
Chromosomal Aberrations0low120
Chromosomal Breakage0low10
Chromosomal Breaks0low10
Chromosome 7q11.23 Deletion Syndrome0low10
Chromosome Aberrations0low120
Chromosome Abnormalities0low120
Chromosome Breakage0low10
Chromosome Breaks0low10
Chromosome-Defective Micronuclei0low30
Chronic Actinic Dermatitis0low10
Chronic Disease0low40
Chronic Encephalopathy0low30
Chronic Illness0low40
Chronic Insomnia0medium4413
Chronic Kidney Failure0low10
Chronic Post-operative Pain0medium31
Chronic Post-surgical Pain0medium31
Chronic Post-Traumatic Stress Disorder0medium11
Chronic Postoperative Pain0medium31
Chronic Postsurgical Pain0medium31
Chronic Progressive External Ophthalmoplegia0low10
Chronic Progressive Hereditary Chorea (Huntington)0low10
Chronically Ill0low40
Circulatory Collapse0low10
Circulatory Failure0low10
Claustrophobia0low10
Cleft Palate0medium11
Cleft Palate, Isolated0medium11
Clerambault Syndrome0low20
Clonic Seizure0medium382
Clonic Seizures0medium382
Clostridium tetani Infection0low120
CNS Disease0low10
CNS Diseases0low10
CNS Disorders, Intracranial0medium111
CNS Metabolic Disorders0low10
CNS Metabolic Disorders, Acquired0low10
Coagulation Disorders, Blood0low10
Coarse Tremor0medium32
Cochlear Hearing Loss0medium31
Coenuriasis0low10
Cognition Disorders0low10
Cogwheel Rigidity0low10
Colic0low10
Colon Cancer0low20
Colon Neoplasms0low20
Colonic Cancer0low20
Colonic Diseases0low20
Colonic Inertia0medium11
Colonic Neoplasms0low20
Coma0low40
Comatose0low40
Commotio Cerebri0low10
Communicating Hydrocephalus0low10
Complex Partial Seizure0medium382
Complex Partial Seizures0medium382
Complex Partial Status Epilepticus0low80
Complication, Postoperative0medium82
Complications, Labor0medium21
Complications, Pregnancy0medium51
Compression Atelectasis0low10
Compression Pulmonary Atelectasis0low10
Concomitant Strabismus0low10
Concussion, Intermediate0low10
Concussion, Mild0low10
Concussion, Severe0low10
Conductive Hearing Loss0low10
Confusion0low10
Confusion, Post-Ictal0low10
Confusion, Reactive0low10
Confusional State0low10
Congenital Abnormalities, Nervous System0low10
Congenital Anomalies, Nervous System0low10
Congenital Heart Defect0medium101
Congenital Heart Defects0medium101
Congenital Heart Disease0medium101
Congenital Hydrocephalus0low10
Congenital Malformations, Nervous System0low10
Congenital Subglottic Stenosis0low10
Congenital Zika Syndrome0low10
Congenital Zika Virus Infection0low10
Congestive Atelectasis0low10
Congestive Heart Failure0low40
Congestive Pulmonary Atelectasis0low10
Conjugate Nystagmus0low10
Consciousness, Loss of0medium21
Constipation0medium11
Contact Dermatitis0low20
Contiguous Gene Syndrome, Williams0low10
Continuous Tremor0medium32
Contraction Pulmonary Atelectasis0low10
Contusions0low10
Convalescence0low10
Convergence Nystagmus0low10
Convergent Comitant Strabismus0low10
Convulsion0medium382
Convulsion, Non-Epileptic0medium382
Convulsions0medium382
Convulsions, Febrile0low30
Convulsions, Grand Mal0low30
Convulsive Seizure0medium382
Convulsive Seizures0medium382
Coronary Artery Vasospasm0low10
Coronary Disease0low30
Coronary Heart Disease0low30
Coronary Vasospasm0low10
Corpse0low10
Cough0low10
CPEO0low10
Crackles0low20
Cranial Pain0low10
Craniocerebral Injuries0low10
Craniocerebral Trauma0low10
Craniofacial Pain0low10
Cranioschisis0low10
Crescendo Transient Ischemic Attacks0low50
Critical Illness0medium11
Critically Ill0medium11
Croup0low20
Cruor0low40
Crushing Skull Injury0low10
Cryptogenic Infantile Spasms0low20
Cryptogenic Myoclonic Epilepsy0low10
Cryptogenic Tonic-Clonic Epilepsy0low30
Cryptogenic West Syndrome0low20
Cryptorchidism0low10
Cryptorchidism, Unilateral Or Bilateral0low10
Cryptorchism0low10
Curling Ulcer0low10
Curling's Ulcer0low10
CVA (Cerebrovascular Accident)0low30
Cyanosis0low40
Cyclothymia0low10
Cyclothymic Disorder0low10
Cyclothymic Personality0low10
Cyst0low20
Cystic Fibrosis0low20
Cystic Fibrosis of Pancreas0low20
Cystic Periventricular Leukomalacia0low10
Cysts0low20
Cytogenetic Aberrations0low120
Cytogenetic Abnormalities0low120
Cytotoxic Brain Edema0low20
Cytotoxic Cerebral Edema0low20
Darkness Tremor0medium32
Daytime Sleepiness0low30
Daytime Somnolence0low30
Deafness Neurosensory0medium31
Deafness, Transitory0low10
Death, Sudden0low10
Decay, Dental0low10
Decerebrate Posturing0low40
Decerebrate State0low40
Decompression Sickness0low10
Decorticate Rigidity0low40
Decorticate State0low40
Defects, Congenital Heart0medium101
Deficiency Diseases0low10
Deficiency Syndrome, Immunologic0low10
Deficiency Syndromes, Antibody0low10
Deficiency Syndromes, Immunologic0low10
Deficiency, Ascorbic Acid0low10
Deficiency, Factor II0low20
Deficiency, Mental0low50
Deficiency, Oxygen0low130
Deficiency, Pyridoxine0low10
Deficiency, Vitamin B 120low20
Deficiency, Vitamin B 60low10
Deficiency, Vitamin B120low20
Deficiency, Vitamin B60low10
Deficiency, Vitamin C0low10
Delayed Effects, Prenatal Exposure0low30
Delayed Onset Post-Traumatic Stress Disorder0medium11
Delirium0medium31
Delirium of Mixed Origin0medium31
Delirium Tremens0low20
Delirium Tremens, Alcohol Withdrawal Induced0low20
Delirium, Dementia, Amnestic, Cognitive Disorders0low20
Delusional Disorder0low10
Dementia Praecox0medium125
Dementia, Alzheimer Type0low20
Dementia, Presenile0low20
Dementia, Primary Senile Degenerative0low20
Dementia, Senile0low20
Dental Caries0low10
Dental Decay0low10
Dental White Spot0low10
Dental White Spots0low10
Dependence, Opioid0medium11
Depression0medium131
Depression, Bipolar0medium11
Depression, Endogenous0low20
Depression, Neurotic0low20
Depression, Reactive0medium11
Depression, Unipolar0low20
Depressive Syndrome0low20
Dermatitis0low10
Dermatitis Exfoliativa0low10
Dermatitis Exfoliative0low10
Dermatitis Exfoliative Generalised0low10
Dermatitis Exfoliative Generalized0low10
Dermatitis Medicamentosa0low40
Dermatitis Venenata0low20
Dermatitis, Actinic0low10
Dermatitis, Adverse Drug Reaction0low40
Dermatitis, Allergic Contact0low20
Dermatitis, Allergic Eczematous0low20
Dermatitis, Contact0low20
Dermatitis, Contact, Allergic0low20
Dermatitis, Eczematous0low20
Dermatitis, Exfoliative0low10
Dermatitis, Irritant0low10
Dermatitis, Poison Ivy0low10
Dermatitis, Primary Irritant0low10
Dermatitis, Toxicodendron0low10
Dermatoses0low10
Dermatosis0low10
Development Disorders, Child0low10
Developmental Academic Disability0low10
Developmental Academic Disorder0low10
Developmental Delay Disorders0low10
Developmental Disabilities0low10
Developmental Disabilities of Scholastic Skills0low10
Developmental Disorder, Speech or Language0low10
Developmental Disorders of Scholastic Skills0low10
Developmental Language Disorders0low10
Developmental Psychomotor Disorders0low10
Diabetes Mellitus0low10
Diabetes Mellitus, Brittle0low10
Diabetes Mellitus, Experimental0low10
Diabetes Mellitus, Insulin-Dependent0low10
Diabetes Mellitus, Insulin-Dependent, 10low10
Diabetes Mellitus, Juvenile-Onset0low10
Diabetes Mellitus, Ketosis-Prone0low10
Diabetes Mellitus, Sudden-Onset0low10
Diabetes Mellitus, Type 10low10
Diabetes Mellitus, Type I0low10
Diabetes, Autoimmune0low10
Diabetic Angiopathies0low10
Diabetic Vascular Complications0low10
Diabetic Vascular Diseases0low10
Diagnosis, Psychiatric0medium134
Diaphragmatic Hernia0low10
Diarrhea0low10
Diathesis0low10
Diffuse Myofascial Pain Syndrome0low10
Dilatation, Pathologic0low10
Dilatation, Pathological0low10
Dilatations, Pathologic0low10
Dilatations, Pathological0low10
DIMS (Disorders of Initiating and Maintaining Sleep)0medium4413
Dipylidiasis0low10
Disabilities, Developmental0low10
Disability, Intellectual0low50
Disease0low30
Disease Models, Animal0low190
Disease Susceptibility0low10
Disease, Pulmonary0low20
Diseases, Occupational0low10
Diseases, Peripheral Vascular0low10
Diseases, Pulmonary0low20
Disorders of Excessive Somnolence0low30
Disorders of Initiating and Maintaining Sleep0medium4413
Disorders of the Autonomic Nervous System0low10
Disorders, Blood Coagulation0low10
Disorientation0low10
Dissociated Nystagmus0low10
Dissociated Vertical Deviation0low10
Distorted Hearing0low40
Doenu00E7as do Sistema Nervoso Central@pt0low10
DOES (Disorders of Excessive Somnolence)0low30
Dog Diseases0low20
Doose Syndrome0low10
Down Syndrome0low10
Down Syndrome, Partial Trisomy 210low10
Down's Syndrome0low10
Dravet Syndrome0low10
Dropsy0low10
Drug Abuse0low210
Drug Addiction0low210
Drug Allergy0medium91
Drug Dependence0low210
Drug Eruptions0low40
Drug Habituation0low210
Drug Hypersensitivity0medium91
Drug Overdose0low170
Drug Side Effects0low90
Drug Toxicity0low90
Drug Use Disorders0low210
Drug Withdrawal Symptoms0medium244
Drug-Induced Abnormalities0low20
Drug-Induced Acute Liver Injury0low100
Drug-Induced Akathisia0low20
Drug-Induced Liver Disease0low100
Drug-Induced Liver Injury0low100
Drug-Induced Stevens Johnson Syndrome0low10
Drug-Induced Stevens-Johnson Syndrome0low10
Drug-Related Side Effects and Adverse Reactions0low90
Drunkenness0low50
Duodenal Ulcer0low10
Dysacusis0low40
Dyschezia0medium11
Dyskinesia Syndromes0medium11
Dyskinesia, Drug-Induced0medium21
Dyskinesia, Medication-Induced0medium21
Dyspnea0low20
Dystonia0low20
Dystonia Deformans Musculorum0low10
Dystonia Deformans Progressiva0low10
Dystonia Disorders0low20
Dystonia Musculorum Deformans0low10
Dystonia, Diurnal0low20
Dystonia, Hereditary0low20
Dystonia, Limb0low20
Dystonia, Paroxysmal0low20
Dystonia, Primary0low20
Dystonia, Psychogenic0low20
Dystonia, Secondary0low20
Dystonias, Sporadic0low20
Dystonic Disorders0low20
E coli Infections0low10
E. coli Infection0low10
Early Awakening0medium4413
Early Childhood Epilepsy, Myoclonic0low10
Early Childhood, Myoclonic Epilepsy0low10
Early Onset Alzheimer Disease0low20
Eclampsia0low10
Ectasia0low10
Ectopic Heartbeats0low10
Eczema0low20
Eczema, Contact0low20
Edema0low10
Edema, Laryngeal0low10
Edema, Pulmonary0low20
Edemas, Pulmonary0low20
Ehrlich Ascites Tumor0low10
EHS Tumor0low10
Electric Injuries0low20
Electrocution, Accidental0low20
Electrolytes0low40
Embolic Infarction, Middle Cerebral Artery0low20
Embolism and Thrombosis, Brain0low10
Embolism, Brain0low10
Embolism, Intracranial0low10
Embolism, Pulmonary0low10
Embolisms, Pulmonary0low10
Embolus, Middle Cerebral Artery0low20
Emergencies0medium61
Emesis0medium113
Emesis, Postoperative0low20
Encephalitis0low10
Encephalitis, Rasmussen0low10
Encephalomalacia, Periventricular0low10
Encephalomeningitis0low10
Encephalomyelitis, Subacute Necrotizing0low10
Encephalomyelopathy, Subacute Necrotizing0low10
Encephalon Diseases0medium111
Encephalopathies, Metabolic0low10
Encephalopathy0medium111
Encephalopathy, Arsenic0low10
Encephalopathy, Chronic0low30
Encephalopathy, Hypoxic0medium31
Encephalopathy, Ischemic0low100
Encephalopathy, Metabolic, Acquired0low10
Encephalopathy, Myoclonic0low10
Encephalopathy, Subacute Necrotizing0low10
Encephalopathy, Subacute Necrotizing, Infantile0low10
Encephalopathy, Subacute Necrotizing, Juvenile0low10
End-Stage Kidney Disease0low10
End-Stage Renal Disease0low10
Endothelioma, Vascular0low10
Endotoxin Shock0low20
Enfermedades del Sistema Nervioso Central@es0low10
Enlarged Liver0low10
Enlarged Spleen0low10
ENT Diseases0medium11
Enterocolitis0low10
Enuresis0low30
Epidermal Necrolysis, Toxic0low10
Epilepsies, Myoclonic0low10
Epilepsy0medium211
Epilepsy Juvenile Absence0low20
Epilepsy, Absence0low20
Epilepsy, Absence, Atypical0low20
Epilepsy, Benign Psychomotor, Childhood0low20
Epilepsy, Cryptogenic0medium211
Epilepsy, Early Childhood, Myoclonic0low10
Epilepsy, Grand Mal0low30
Epilepsy, Lateral Temporal0low20
Epilepsy, Major0low30
Epilepsy, Minor0low20
Epilepsy, Myoclonic, Early Childhood0low10
Epilepsy, Myoclonic, Infantile0low10
Epilepsy, Myoclonic, Infantile, Benign0low10
Epilepsy, Myoclonic, Infantile, Severe0low10
Epilepsy, Myoclonus0low10
Epilepsy, Petit Mal0low20
Epilepsy, Progressive Myoclonic 10low10
Epilepsy, Progressive Myoclonic 1a0low10
Epilepsy, Progressive Myoclonic Type 10low10
Epilepsy, Progressive Myoclonus 10low10
Epilepsy, Temporal Lobe0low20
Epilepsy, Tonic-Clonic0low30
Epilepsy, Tonic-Clonic, Cryptogenic0low30
Epilepsy, Tonic-Clonic, Familial0low30
Epilepsy, Tonic-Clonic, Symptomatic0low30
Epilepsy, Uncinate0low20
Epileptic Seizure0medium382
Epileptic Seizures0medium382
Equine Diseases0low80
Erysipelas0low10
Erythema Multiforme0low10
Erythroderma0low10
Escherichia coli Infections0low10
Esophageal Diseases0low10
Esophageal Reflux0low10
Esophageal Stenosis0low20
Esophageal Stricture0low20
ESRD0low10
Etat Marbre0medium11
Ethanol Abuse0medium132
Exanthem0low10
Exanthema0low10
Excessive Daytime Sleepiness0low30
Excessive Somnolence Disorders0low30
Excitement, Psychomotor0medium51
Exomphalos0low10
Experimental Diabetes Mellitus0low10
Experimental Hepatoma0low40
Experimental Hepatomas0low40
Experimental Liver Neoplasms0low40
Experimental Lung Inflammation0medium31
Experimental Neoplasms0low40
Experimental Sarcoma0low10
Experimental Sarcomas0low10
Extensor Rigidity0low10
Extrapyramidal Rigidity0low10
Extrasystole0low10
Extrasystoles0low10
Eye Diseases0low40
Eye Disorders0low40
Eye Pain0low10
Face Pain0low10
Facial Injuries0low10
Facial Pain0low10
Factor II Deficiency0low20
Familial Alzheimer Disease (FAD)0low20
Familial Atrial Fibrillation0low20
Familial Brachial Plexus Neuritis0low10
Familial Dementia0medium21
Familial Dystonia0low20
Familial Dystonia, Autosomal Dominant0low20
Familial Dystonia, Autosomal Recessive0low20
Familial Dystonia, Idiopathic0low20
Familial Tonic-Clonic Epilepsy0low30
Fasting Hypoglycemia0low20
Fatigable Positional Nystagmus0low10
Fatigue0medium52
Fatigue, Mental0medium11
Febrile Convulsion Seizure0low30
Febrile Fit0low30
Febrile Seizures0low30
Feline Diseases0low10
Female Genital Diseases0low10
Female Pattern Baldness0low20
Fetal Cerebral Ventriculomegaly0low10
Fetal Death0low10
Fetal Demise0low10
Fetal Distress0low10
Fetal Mummification0low10
Fever0medium51
Fever Convulsion0low30
Fever Seizure0low30
Fever, Zika0low10
Fibrocystic Disease of Pancreas0low20
Fibromyalgia0low10
Fibromyalgia-Fibromyositis Syndrome0low10
Fibromyalgia, Primary0low10
Fibromyalgia, Secondary0low10
Fibromyositis-Fibromyalgia Syndrome0low10
Fibrositis0low10
Fine Tremor0medium32
Finger Injuries0low10
Flaccid Quadriplegia0low10
Flaccid Tetraplegia0low10
Flexibility, Waxy0low10
Fluoride Poisoning0low10
Focal Brain Injuries0low40
Focal Dystonia0low20
Focal Onset Alzheimer's Disease0low20
Food Allergy0low10
Food Hypersensitivity0low10
Forehead Trauma0low10
Fra(X) Syndrome0low10
Fragile X Mental Retardation Syndrome0low10
Fragile X Syndrome0low10
Fragile X-F Mental Retardation Syndrome0low10
FRAXA Syndrome0low10
FRAXE Syndrome0low10
Frontal Region Trauma0low10
Gastric Acid Aspiration Syndrome0low10
Gastric Acid Reflux0low10
Gastric Acid Reflux Disease0low10
Gastric Diseases0low20
Gastric Fistula0low20
Gastric Rupture0low10
Gastric Ulcer0low30
Gastro-Esophageal Reflux0low10
Gastro-Esophageal Reflux Disease0low10
Gastro-oesophageal Reflux0low10
Gastroduodenal Ulcer0low20
Gastroenteritis0low10
Gastroesophageal Reflux0low10
Gastroesophageal Reflux Disease0low10
Gastrointestinal Hemorrhage0low30
Gegenhalten0low10
Gelineau Syndrome0low10
Gelineau's Syndrome0low10
Generalized Absence Seizure0medium382
Generalized Absence Seizures0medium382
Generalized Convulsive Status Epilepticus0low80
Generalized Headache0low10
Generalized Tonic-Clonic Seizures0medium382
Genetic Non-Disjunction0low30
Genetic Nondisjunction0low30
Genital Diseases, Female0low10
Genotoxicant-Induced Micronuclei0low30
GERD0low10
Gout0low10
Graefe Disease0low10
Graefe's Disease0low10
Grand Mal Seizure Disorder0low30
Grand Mal Status Epilepticus0low80
Gynecologic Diseases0low10
Hair Loss0low20
Hallucination of Body Sensation0low40
Hallucinations0low40
Hallucinations, Auditory0low40
Hallucinations, Dissociative0low40
Hallucinations, Elementary0low40
Hallucinations, Formed, of People0low40
Hallucinations, Gustatory0low40
Hallucinations, Hypnagogic0low40
Hallucinations, Hypnapompic0low40
Hallucinations, Internal Body Sensation0low40
Hallucinations, Kinesthetic0low40
Hallucinations, Mood Congruent0low40
Hallucinations, Mood Incongruent0low40
Hallucinations, Olfactory0low40
Hallucinations, Organic0low40
Hallucinations, Reflex0low40
Hallucinations, Sensory0low40
Hallucinations, Somatic0low40
Hallucinations, Tactile0low40
Hallucinations, Verbal Auditory0low40
Hallucinations, Visual0low40
Hallucinations, Visual, Formed0low40
Hallucinations, Visual, Unformed0low40
Hangman Fracture0low10
Hangman's Fracture0low10
Hashish Abuse0low10
Head Injuries0low10
Head Injuries, Multiple0low10
Head Injury, Minor0low10
Head Injury, Open0low10
Head Injury, Superficial0low10
Head Pain0low10
Head Trauma0low10
Headache0low10
Headache, Migraine0medium134
Headache, Vascular0low10
Hearing Disorders0low40
Hearing Impairment0low10
Hearing Loss0low10
Hearing Loss, Cochlear0medium31
Hearing Loss, Conductive0low10
Hearing Loss, Sensorineural0medium31
Hearing Loss, Transitory0low10
Heart Abnormalities0medium101
Heart Arrest0low40
Heart Attack0medium82
Heart Block0low10
Heart Decompensation0low40
Heart Defect, Congenital0medium101
Heart Defects, Congenital0medium101
Heart Disease, Ischemic0low10
Heart Diseases0medium41
Heart Disorders0medium41
Heart Failure0low40
Heart Failure, Congestive0low40
Heart Failure, Left-Sided0low40
Heart Failure, Right-Sided0low40
Heart Septal Defects, Ventricular0low10
Heart Valve Diseases0medium11
Heart Valvular Disease0medium11
Heart, Malformation Of0medium101
Heat Stroke0low10
Heatstroke0low10
Hebephrenic Schizophrenia0low10
Hemangio-Endothelioma0low10
Hemangioendothelioma0low10
Hematochezia0low30
Hemicrania0low10
Hemicrania Migraine0medium134
Hemiplegia0low60
Hemiplegia, Crossed0low60
Hemiplegia, Flaccid0low60
Hemiplegia, Infantile0low60
Hemiplegia, Post-Ictal0low60
Hemiplegia, Spastic0low60
Hemiplegia, Transient0low60
Hemorrhage0medium31
Hemorrhage, Cerebral0low30
Hemorrhage, Cerebrum0low30
Hemorrhage, Gastrointestinal0low30
Hepatic Cancer0low40
Hepatic Neoplasms0low40
Hepatitis, Drug-Induced0low100
Hepatitis, Toxic0low100
Hepatocellular Cancer0low40
Hepatocellular Carcinoma0low20
Hepatoma0low20
Hepatoma, Benign0low20
Hepatoma, Experimental0low40
Hepatoma, Morris0low40
Hepatoma, Novikoff0low40
Hepatomas, Experimental0low40
Hepatomegaly0low10
Hereditary Brachial Plexus Neuropathy0low10
Hereditary Neuralgic Amyotrophy0low10
Heredofamilial Neuritis with Brachial Plexus Predilection0low10
Hernia, Diaphragmatic0low10
Hernia, Inguinal0medium11
Hernia, Umbilical0low10
Heroin Abuse0medium11
Heroin Addiction0medium11
Heroin Dependence0medium11
Heroin Smoking0medium11
Herpes Zoster0low10
Hives0low10
Hoffman's Reflex0medium31
Horizontal Nystagmus0low10
Horse Diseases0low80
Huntington Chorea0low10
Huntington Chronic Progressive Hereditary Chorea0low10
Huntington Disease0low10
Huntington Disease, Akinetic-Rigid Variant0low10
Huntington Disease, Juvenile0low10
Huntington Disease, Juvenile-Onset0low10
Huntington Disease, Late Onset0low10
Huntington's Chorea0low10
Huntington's Disease0low10
Hyaline Membrane Disease0low10
Hydrocephalus0low10
Hydrocephalus Ex-Vacuo0low10
Hydrocephaly0low10
Hydrops0low10
Hyperactivity, Motor0medium41
Hyperacusia0low10
Hyperacusis0low10
Hyperalgesia0low10
Hyperalgesia, Mechanical0low10
Hyperalgesia, Primary0low10
Hyperalgesia, Secondary0low10
Hyperalgesia, Tactile0low10
Hyperalgesia, Thermal0low10
Hyperalgesic Sensations0low10
Hyperalgia0low10
Hyperalgia, Mechanical0low10
Hyperalgia, Primary0low10
Hyperalgia, Secondary0low10
Hyperbilirubinemia0low10
Hyperbilirubinemia, Hereditary0low10
Hyperbilirubinemia, Rotor Type0low10
Hypercalcemia-Supravalvar Aortic Stenosis0low10
Hypercapnia0low30
Hypercapnic Acute Respiratory Failure0low110
Hypercapnic Respiratory Failure0low110
Hyperhidrosis0low10
Hyperidrosis0low10
Hyperkinesia0medium41
Hyperkinesia, Generalized0medium41
Hyperkinesis0medium41
Hyperkinetic Movements0medium41
Hyperkinetic Syndrome0low10
Hypernatremia0low10
Hyperoxia0low20
Hyperplasia0low10
Hyperreflexia0medium31
Hypersensitivity0low10
Hypersensitivity, Atopic0low10
Hypersensitivity, Contact0low20
Hypersensitivity, Drug0medium91
Hypersensitivity, Food0low10
Hypersensitivity, Immediate0low10
Hypersensitivity, Type I0low10
Hypersomnia0low30
Hypersomnia with Periodic Respiration0low40
Hypersomnia, Recurrent0low30
Hypersomnolence0low30
Hypersomnolence Disorders0low30
Hypersomnolence Disorders, Primary0low30
Hypersomnolence Disorders, Secondary0low30
Hypertension0low30
Hyperthyroid0low20
Hyperthyroidism0low20
Hypertriglyceridemia0low10
Hypertrophy0low30
Hypertropia0low10
Hypoacusis0low10
Hypocalcemia0low10
Hypoglycemia0low20
Hyponatremia0low10
Hypoprothrombinemia0low20
Hypoprothrombinemias0low20
Hyporeflexia0medium31
Hyposalivation0medium11
Hypotension0medium91
Hypotension, Vascular0medium91
Hypothermia0low60
Hypothermia, Accidental0low60
Hypothyroidism0low10
Hypoventilation0low20
Hypovolemic Shock0low10
Hypoxemia0low130
Hypoxemic Acute Respiratory Failure0low110
Hypoxemic Respiratory Failure0low110
Hypoxia0low130
Hypoxia, Brain0medium31
Hypoxia, Cerebral0medium31
Hypoxic Brain Damage0medium31
Hypoxic Encephalopathy0medium31
Hypsarrhythmia0low20
Icterus0low40
IDDM0low10
Idiocy0low50
Idiopathic Myoclonic Epilepsy0low10
Idiopathic Parkinson Disease0low20
Idiopathic Parkinson's Disease0low20
Idiopathic Torsion Dystonia0low10
Idiopathic Ventricular Tachycardia0low10
IgE-Mediated Hypersensitivity0low10
Illuminating Gas Poisoning0low10
Immunologic Deficiency Syndrome0low10
Immunologic Deficiency Syndromes0low10
Immunological Deficiency Syndromes0low10
Inadequate Sleep0medium81
Infant Malnutrition0low10
Infant Nutrition Disorders0low10
Infant Overnutrition0low10
Infant, Newborn, Diseases0low100
Infant, Premature, Diseases0medium41
Infantile Colic0low10
Infantile Leigh Disease0low10
Infantile Malnutrition0low10
Infantile Severe Myoclonic Epilepsy0low10
Infantile Spasms0low20
Infantile Subacute Necrotizing Encephalopathy0low10
Infarction, Cerebral0low40
Infarction, Cerebral, Left Hemisphere0low40
Infarction, Cerebral, Right Hemisphere0low40
Infarction, Left Hemisphere, Cerebral0low40
Infarction, Middle Cerebral Artery0low20
Infarction, Right Hemisphere, Cerebral0low40
Infection0low10
Infection and Infestation0low10
Infection, Postoperative Wound0low20
Infection, Surgical Wound0low20
Infections0low10
Infections and Infestations0low10
Infections, E coli0low10
Infections, Escherichia coli0low10
Infections, Respiratory0low10
Infections, Respiratory Tract0low10
Infections, Upper Respiratory0low10
Infections, Upper Respiratory Tract0low10
Infections, Yersinia0low10
Inferior Dislocation0low10
Inflammation, Brain0low10
Inguinal Cryptorchidism0low10
Inguinal Hernia0medium11
Inguinal Hernia, Direct0medium11
Inguinal Hernia, Indirect0medium11
Injuries, Abdominal0low10
Injuries, Acute Brain0low40
Injuries, Arm0low10
Injuries, Birth0low20
Injuries, Brain0low40
Injuries, Craniocerebral0low10
Injuries, Electric0low20
Injuries, Facial0low10
Injuries, Finger0low10
Injuries, Head0low10
Injuries, Leg0low10
Injuries, Radiation0low10
Injuries, Spinal Cord0low30
Injury, Ischemia-Reperfusion0low10
Injury, Reperfusion0low10
Inorganic Arsenic Poisoning0low10
Insomnia0medium4413
Insomnia Disorder0medium4413
Insufficient Sleep0medium81
Insufficient Sleep Syndrome0medium81
Insulin-Dependent Diabetes Mellitus 10low10
Intellectual Development Disorder0low50
Intellectual Disability0low50
Intention Tremor0medium32
Intermittent Tremor0medium32
Intestinal Diseases0low10
Intestinal Obstruction0low20
Intoxication, Alcoholic0low50
Intracerebral Hemorrhage0low30
Intracranial Arteriosclerosis0medium21
Intracranial Atherosclerosis0medium21
Intracranial Central Nervous System Disorders0medium111
Intracranial CNS Disorders0medium111
Intracranial Edema0low20
Intracranial Embolism0low10
Intracranial Embolism and Thrombosis0low10
Intracranial Neoplasms0low10
Intraocular Pressure0low20
Intraoperative Awareness0low10
Intraventricular Septal Defects0low10
Intussusception0low10
Intususception0low10
Invagination, Intestinal0low10
Involuntary Quiver0medium32
Irritant Dermatitis0low10
Ischemia0low20
Ischemia-Reperfusion Injury0low10
Ischemia, Cerebral0low100
Ischemia, Myocardial0low10
Ischemic Attack, Transient0low50
Ischemic Encephalopathy0low100
Ischemic Heart Disease0low10
Itching0low20
Jackknife Seizures0low20
Jacksonian Seizure0medium382
Jactatio Capitis Nocturna0medium11
Jaundice0low40
Jaundice, Hemolytic0low40
Jerk Nystagmus0low10
Joint Dislocations0low10
Joint Subluxations0low10
Juvenile Absence Epilepsy0low20
Juvenile Huntington Disease0low10
Juvenile Leigh Disease0low10
Juvenile Subacute Necrotizing Encephalopathy0low10
Juvenile-Onset Diabetes0low10
Juvenile-Onset Huntington Disease0low10
Kandinsky Syndrome0low20
Kanner's Syndrome0low30
Katayama Fever0low10
Keskushermoston sairaudet@fi0low10
Kidney Cancer0low10
Kidney Diseases0low10
Kidney Failure, Acute0low10
Kidney Failure, Chronic0low10
Kidney Insufficiency, Acute0low10
Kidney Neoplasms0low10
Koch's Disease0low10
Kochs Disease0low10
Labor Complications0medium21
Labor, Premature0low10
Lactic Acidosis0medium21
Language Delay0low10
Language Development Disorders0low10
Language Disorders, Developmental0low10
Laryngeal Edema0low10
Laryngeal Spasm0low20
Laryngeal Stenosis0low10
Laryngismus0low20
Laryngospasm0low20
Laryngostenosis0low10
Lassitude0medium52
Late Effects, Prenatal Exposure0low30
Late Onset Alzheimer Disease0low20
Late-Onset Huntington Disease0low10
Lazy Eye0low20
Lead Poisoning0low20
Learning Disabilities0low10
Learning Disorders0low10
Learning Disorders, Adult0low10
Learning Disturbance0low10
Left Hemisphere, Cerebral Infarction0low40
Left Hemisphere, Infarction, Cerebral0low40
Left Middle Cerebral Artery Infarction0low20
Left-Sided Heart Failure0low40
Leg Injuries0low10
Leigh Disease0low10
Leigh Disease, Infantile0low10
Leigh Disease, Juvenile0low10
Leigh Syndrome0low10
Leigh's Disease0low10
Lens Opacities0medium72
Lethal Catatonia0low10
Leucocythaemia0low20
Leucocythemia0low20
Leucomalacia, Periventricular0low10
Leukemia0low20
Leukemia L51780low10
Leukemia, Pre-B-Cell0low10
Leukomalacia, Periventricular0low10
Leukorrhea0low10
Lewy Body Parkinson Disease0low20
Lewy Body Parkinson's Disease0low20
Libman-Sacks Disease0low20
Lightning Attacks0low20
Liver Abscess0low10
Liver Cancer0low40
Liver Cancer, Adult0low20
Liver Cell Carcinoma0low20
Liver Cell Carcinoma, Adult0low20
Liver Diseases0low60
Liver Dysfunction0low60
Liver Injury, Drug-Induced0low100
Liver Injury, Drug-Induced, Acute0low100
Liver Neoplasms0low40
Liver Neoplasms, Experimental0low40
Livor Mortis0low40
Lobar Pneumonia0medium31
Lock Jaw0low10
Lockjaw0low10
Long Sleeper Syndrome0medium141
Loudness Perception Disturbances0low10
Loudness Recruitment0low10
Low Blood Pressure0medium91
Luft Disease0low10
Luft's Disease0low10
Lundborg-Unverricht Syndrome0low10
Lung Cancer0low10
Lung Collapse0low10
Lung Diseases0low20
Lung Inflammation0medium31
Lung Neoplasms0low10
Lung Sounds0low20
Lupus Erythematosus Disseminatus0low20
Lupus Erythematosus, Systemic0low20
Luxatio Erecta0low10
Lyell's Syndrome0low10
Lymphocytopenia0low10
Lymphoma L51780low10
Lymphopenia0low10
Maculopapular Drug Eruption0low40
Maculopapular Exanthem0low40
Major Motor Seizure Disorder0low30
Maladie du systu00E8me nerveux central@fr0low10
Malattie del sistema nervoso centrale@it0low10
Male Pattern Baldness0low20
Malformations, Nervous System, Congenital0low10
Malignancy0low90
Malignant Neoplasms0low90
Malignant Neoplasms, Brain0low10
Malignant Primary Brain Neoplasms0low10
Malignant Primary Brain Tumors0low10
Malnutrition in Infant0low10
Malnutrition, Infant0low10
Manic Depression0medium11
Manic Disorder0medium11
Manic-Depressive Psychosis0medium11
Mar (X) Syndrome0low10
Marginal Ulcer0low20
Marihuana Abuse0low10
Marijuana Abuse0low10
Marijuana Dependence0low10
Marker X Syndrome0low10
Martin-Bell Syndrome0low10
Masseter Muscle Spasm0low10
Masseter Spasm0low10
Massive Tremor0medium32
MCA Infarct0low20
MCA Infarction0low20
Mechanical Allodynia0low10
Mechanical Hyperalgesia0low10
Mechanical Strabismus0low10
Medication-Induced Dyskinesia0medium21
Mediterranean Myoclonic Epilepsy0low10
Megaconial Myopathies0low10
Melancholia0low20
Mendelson Syndrome0low10
Mendelson's Syndrome0low10
Meningoencephalitis0low10
Menopause0low10
Mental Deficiency0low50
Mental Disorders0medium134
Mental Disorders, Organic0low20
Mental Disorders, Severe0medium134
Mental Fatigue0medium11
Mental Illness0medium134
Mental Retardation0low50
Mental Retardation, Psychosocial0low50
Mental Retardation, X-Linked, Associated With Fragile Site Fraxe0low10
Mental Retardation, X-Linked, Associated With Marxq280low10
Mercury Poisoning0low20
Metabolic Brain Diseases0low10
Metabolic Brain Diseases, Acquired0low10
Metabolic Brain Syndrome0low10
Metabolic Brain Syndrome, Acquired0low10
Metabolic Brain Syndromes0low10
Metabolic Brain Syndromes, Acquired0low10
Metabolic Diseases, Acquired, Nervous System0low10
Metabolic Disorder, Central Nervous System, Acquired0low10
Metabolic Disorders, Brain0low10
Metabolic Disorders, Central Nervous System0low10
Metabolic Disorders, CNS0low10
Metabolic Disorders, CNS, Acquired0low10
Metabolic Encephalopathies0low10
Microangiopathy, Diabetic0low10
Micronuclei, Chromosome-Defective0low30
Micronuclei, Genotoxicant-Induced0low30
Micronucleus, Chromosome-Defective0low30
Middle Cerebral Artery Circulation Infarction0low20
Middle Cerebral Artery Embolic Infarction0low20
Middle Cerebral Artery Embolus0low20
Middle Cerebral Artery Infarction0low20
Middle Cerebral Artery Occlusion0low20
Middle Cerebral Artery Stroke0low20
Middle Cerebral Artery Syndrome0low20
Middle Cerebral Artery Thrombosis0low20
Middle Cerebral Artery Thrombotic Infarction0low20
Migraine0medium134
Migraine Disorders0medium134
Migraine Headache0medium134
Migraine Variant0medium134
Mild Traumatic Brain Injury0low10
Minimal Brain Dysfunction0low10
Mitochondrial Myopathies0low10
Mitochondrial Myopathy0low10
Mitochondrial Ocular Myopathy0low10
Mixed Central and Obstructive Sleep Apnea0low40
Mongolism0low10
Monoplegia0low60
Moral Injury0medium11
Morbilliform Drug Reaction0low40
Morbilliform Exanthem0low40
Morphine Abuse0low10
Morphine Addiction0low10
Morphine Dependence0low10
Mouth Diseases0low10
Mouth Dryness0medium11
Movement Disorder Syndromes0medium11
Movement Disorders0medium11
Movement Disorders, Rhythmic Nocturnal0medium11
Mucoviscidosis0low20
Multidirectional Nystagmus0low10
Multiple Head Injuries0low10
Munchausen Syndrome by Proxy0low10
Muscle Contraction0low120
Muscle Disorders0low10
Muscle Dystonia0low20
Muscle Relaxation0low10
Muscle Rigidity0low10
Muscle Weakness0low10
Muscular Diseases0low10
Muscular Weakness0low10
Mushroom Poisoning0low20
Mycobacterium tuberculosis Infection0low10
Mycoplasma-Induced Stevens Johnson Syndrome0low10
Mycoplasma-Induced Stevens-Johnson Syndrome0low10
Myelopathy0low10
Myelopathy, Traumatic0low30
Myocardial Failure0low40
Myocardial Infarct0medium82
Myocardial Infarction0medium82
Myocardial Ischemia0low10
Myocarditis0low10
Myoclonic Absence Epilepsy0low10
Myoclonic Astatic Epilepsy0low10
Myoclonic Encephalopathy0low10
Myoclonic Epilepsy0low10
Myoclonic Epilepsy of Unverricht and Lundborg0low10
Myoclonic Epilepsy, Benign Infantile0low10
Myoclonic Epilepsy, Early Childhood0low10
Myoclonic Epilepsy, Infantile0low10
Myoclonic Epilepsy, Infantile, Benign0low10
Myoclonic Epilepsy, Infantile, Severe0low10
Myoclonic Epilepsy, Severe Infantile0low10
Myoclonic Epilepsy, Severe, Of Infancy0low10
Myoclonic Jerk0low20
Myoclonic Jerking0low20
Myoclonic Seizure0medium382
Myoclonic Seizure Disorder0low10
Myoclonic Seizures0medium382
Myoclonus0low20
Myoclonus Progressive Epilepsy of Unverricht and Lundborg0low10
Myoclonus Simplex0low20
Myoclonus, Action0low20
Myoclonus, Eyelid0low20
Myoclonus, Intention0low20
Myoclonus, Lower Extremity0low20
Myoclonus, Nocturnal0low20
Myoclonus, Oculopalatal0low20
Myoclonus, Palatal0low20
Myoclonus, Segmental0low20
Myoclonus, Sleep0low20
Myoclonus, Upper Extremity0low20
Myofacial Pain0low10
Myofascial Pain Syndrome, Diffuse0low10
Myopathic Conditions0low10
Myopathies0low10
Myopathies, Mitochondrial0low10
Narcolepsy0low10
Narcolepsy-Cataplexy Syndrome0low10
Narcoleptic Syndrome0low10
Nausea0medium52
Nausea and Vomiting, Postoperative0low20
Nausea, Postoperative0low20
Necrosis0low40
nemoci centru00E1lnu00EDho nervovu00E9ho systu00E9mu@cs0low10
Neonatal Abstinence Syndrome0medium21
Neonatal Cerebral Leukomalacia0low10
Neonatal Diseases0low100
Neonatal Substance Withdrawal0medium21
Neonatal Withdrawal Syndrome0medium21
Neoplasia0low90
Neoplasm0low90
Neoplasms0low90
Neoplasms, Benign0low90
Neoplasms, Brain0low10
Neoplasms, Brain, Benign0low10
Neoplasms, Brain, Malignant0low10
Neoplasms, Brain, Primary0low10
Neoplasms, Colonic0low20
Neoplasms, Experimental0low40
Neoplasms, Experimental Liver0low40
Neoplasms, Hepatic0low40
Neoplasms, Intracranial0low10
Neoplasms, Kidney0low10
Neoplasms, Liver0low40
Neoplasms, Lung0low10
Neoplasms, Pulmonary0low10
Neoplastic Cell Transformation0low10
Neoplastic Transformation, Cell0low10
Nerve Degeneration0low20
Nervous System Abnormalities0low10
Nervous System Acquired Metabolic Diseases0low10
Nervous System Anomalies0low10
Nervous System Congenital Abnormalities0low10
Nervous System Congenital Malformations0low10
Nervous System Diseases0low20
Nervous System Diseases, Autonomic0low10
Nervous System Diseases, Parasympathetic0low10
Nervous System Diseases, Sympathetic0low10
Nervous System Disorders0low20
Nervous System Malformations0low10
Nervous System Malformations, Congenital0low10
Nervous System Poisoning, Arsenic0low10
Nervous System, Organic Arsenic Poisoning0low10
Neuralgia, Amyotrophic0low10
Neuralgic Amyotrophy0low10
Neuralgic Facial Pain0low10
Neuritis With Brachial Predilection0low10
Neuritis, Brachial Plexus0low10
Neurocognitive Disorders0low20
Neurologic Disorders0low20
Neurological Disorders0low20
Neuromuscular Blockade0low20
Neuron Degeneration0low20
Neuroses0medium31
Neuroses, Anxiety0medium31
Neuroses, Phobic0low10
Neuroses, Post-Traumatic0medium11
Neuroses, Posttraumatic0medium11
Neurosis, Depressive0low20
Neurotic Disorders0medium31
Neurotoxicity Syndrome, Arsenical0low10
Nocturnal Leg Cramps0medium11
Nocturnal Sleep Head Banging0medium11
Nocturnal Wandering0low40
Nodding Spasm0low20
Non-Concomitant Strabismus0low10
Non-Convulsive Status Epilepticus0low80
Non-Disjunction, Genetic0low30
Non-Epileptic Seizure0medium382
Non-Epileptic Seizures0medium382
Non-Fatigable Positional Nystagmus0low10
Nonconcomitant Strabismus0low10
Nondisjunction, Genetic0low30
Nonepileptic Seizure0medium382
Nonepileptic Seizures0medium382
Nonorganic Insomnia0medium4413
Nonpsychotic Organic Brain Syndrome0low20
Nonreassuring Fetal Status0low10
Nonstaphylococcal Scalded Skin Syndrome0low10
Nonsustained Ventricular Tachycardia0low10
Nuchal Rigidity0low10
Nutrition Disorders0low10
Nutrition Disorders, Infant0low10
Nutritional Disorders0low10
Nystagmus, Pathologic0low10
Obesity0low10
Obstetric Labor Complications0medium21
Obstetric Labor, Premature0low10
Obstructive Hydrocephalus0low10
Obstructive Sleep Apnea0low10
Obstructive Sleep Apnea Syndrome0low10
Occipital Region Trauma0low10
Occipital Trauma0low10
Occlusion, Middle Cerebral Artery0low20
Occupational Diseases0low10
Occupational Illnesses0low10
Ocular Headache0low10
Ocular Muscular Dystrophy0low10
Ocular Myopathy of Von Graefe-Fuchs0low10
Omphalocele0low10
Open Head Injury0low10
Ophthalmoplegia, Chronic Progressive External0low10
Ophthalmoplegia, Progressive External0low10
Opiate Abuse0medium11
Opiate Addiction0medium11
Opiate Dependence0medium11
Opioid Abuse0medium11
Opioid Addiction0medium11
Opioid Dependence0medium11
Opioid Misuse0medium11
Opioid Use Disorder0medium11
Opioid-Related Disorders0medium11
Oppenheim-Ziehen Disease0low10
Organic Arsenic Poisoning, Nervous System0low10
Organic Brain Syndrome, Nonpsychotic0low20
Organic Catatonic Disorder0low10
Organic Mental Disorders0low20
Organic Mental Disorders, Psychotic0low20
Organic Mental Disorders, Substance-Induced0low210
Organophosphate Poisoning0low10
Organophosphorus Poisoning0low10
Organothiophosphate Poisoning0low10
Organothiophosphonate Poisoning0low10
Orofacial Pain0low10
Orthostatic Headache0low10
OSAHS0low10
Otolaryngologic Diseases0medium11
Otolaryngological Diseases0medium11
Otorhinolaryngologic Disease0medium11
Otorhinolaryngologic Diseases0medium11
Otorhinolaryngological Disease0medium11
Overinclusion0low10
Ovine Diseases0low20
Oxygen Deficiency0low130
Pain0medium122
Pain, Burning0medium122
Pain, Crushing0medium122
Pain, Facial0low10
Pain, Migratory0medium122
Pain, Post-operative0medium31
Pain, Postoperative0medium31
Pain, Radiating0medium122
Pain, Splitting0medium122
Palmo-Mental Reflex0medium31
Palmoplantaris Pustulosis0low10
Palsy0low30
Pancreatic Cystic Fibrosis0low20
Paracousis0low40
Paracusis0low40
Paralysis0low30
Paralysis Agitans0low20
Paralysis, Legs0low10
Paralysis, Lower Extremities0low10
Paralysis, Lower Limbs0low10
Paralysis, Spinal, Quadriplegic0low10
Paranoid Schizophrenia0low10
Paraplegia0low10
Paraplegia, Ataxic0low10
Paraplegia, Cerebral0low10
Paraplegia, Flaccid0low10
Paraplegia, Spastic0low10
Paraplegia, Spinal0low10
Parasympathetic Nervous System Diseases0low10
Parietal Region Trauma0low10
Parkinson Disease0low20
Parkinson Disease, Idiopathic0low20
Parkinson Disease, Secondary0low30
Parkinson Disease, Secondary Vascular0low30
Parkinson Disease, Symptomatic0low30
Parkinson's Disease0low20
Parkinson's Disease, Idiopathic0low20
Parkinson's Disease, Lewy Body0low20
Parkinsonism, Secondary0low30
Parkinsonism, Symptomatic0low30
Paroxysmal Atrial Fibrillation0low20
Paroxysmal Reciprocal Tachycardia0low10
Paroxysmal Sleep0low10
Paroxysmal Supraventricular Tachycardia0low10
Parsonage-Aldren-Turner Syndrome0low10
Parsonage-Turner Syndrome0low10
Partial Seizure0medium382
Partial Seizures0medium382
Partial Trisomy 21 Down Syndrome0low10
Passive Addiction, Neonatal0medium21
Passive Tremor0medium32
Pathologic Dilatation0low10
Pathologic Dilatations0low10
Pattern Baldness0low20
Pendular Nystagmus0low10
Peptic Ulcer0low20
Periodic Alternating Nystagmus0low10
Periorbital Headache0low10
Peripheral Angiopathies0low10
Peripheral Autonomic Nervous System Diseases0low10
Peripheral Nerve Diseases0low10
Peripheral Nervous System Disease0low10
Peripheral Nervous System Diseases0low10
Peripheral Nervous System Disorders0low10
Peripheral Neuropathies0low10
Peripheral Vascular Diseases0low10
Peritonitis0low10
Periventricular Leukomalacia0low10
Permanent Nystagmus0low10
Persistent Atrial Fibrillation0low20
Persistent Postsurgical Pain0medium31
Persistent Tremor0medium32
Pertussis0low10
Petechiae0low10
Petit Mal Convulsion0medium382
Petit Mal Epilepsy0low20
Petit Mal Status0low80
Phlegmasia Alba Dolens0medium11
Phobia, School0low10
Phobias0low10
Phobic Disorders0low10
Phobic Neuroses0low10
Phonophobia0low10
Phorias0low10
Photodermatitis0low10
Photosensitivity Disorders0low10
Photosensitization0low10
Pill Rolling Tremor0medium32
Pituitary Adenoma0low10
Pituitary Cancer0low10
Pituitary Carcinoma0low10
Pituitary Neoplasms0low10
Pituitary Tumors0low10
Plant Poisoning0low10
Plegia0low30
Pleoconial Myopathies0low10
Pleural Rub0low20
Pneumatosis Cystoides Intestinalis0low40
Pneumonia0medium31
Pneumonia, Aspiration0low10
Pneumonia, Lobar0medium31
Pneumonitis0medium31
PNS (Peripheral Nervous System) Diseases0low10
PNS Diseases0low10
Poison Ivy Dermatitis0low10
Poisoning0low140
Poisoning, Arsenic, Nervous System0low10
Poisoning, Blood0low10
Poisoning, Carbon Monoxide0low10
Poisoning, Carbon Tetrachloride0low20
Poisoning, CCl40low20
Poisoning, Fluoride0low10
Poisoning, Illuminating Gas0low10
Poisoning, Lead0low20
Poisoning, Mercury0low20
Poisoning, Mushroom0low20
Poisoning, Plant0low10
Polymyoclonus0low20
Polyneuropathy, Arsenic-Induced0low10
Polyploid0low40
Polyploid Cell0low40
Polyploidy0low40
PONV0low20
Porphyria0low20
Porphyrias0low20
Porphyrin Disorder0low20
Post Traumatic Stress Disorder0medium11
Post-operative Pain0medium31
Post-operative Pain, Acute0medium31
Post-operative Pain, Chronic0medium31
Post-surgical Pain0medium31
Post-Traumatic Hydrocephalus0low10
Post-Traumatic Myelopathy0low30
Post-Traumatic Stress Disorders0medium11
Postabsorptive Hypoglycemia0low20
Posterior Choroidal Artery Infarction0low40
Posterior Circulation Transient Ischemic Attack0low50
Postintubation Croup0low20
Postmortem Changes0low40
Postoperative Complications0medium82
Postoperative Emesis0low20
Postoperative Nausea0low20
Postoperative Nausea and Vomiting0low20
Postoperative Pain0medium31
Postoperative Pain, Acute0medium31
Postoperative Pain, Chronic0medium31
Postoperative Pulmonary Atelectasis0low10
Postoperative Vomiting0low20
Postoperative Wound Infection0low20
Postprandial Hypoglycemia0low20
Postsurgical Pain0medium31
Posttraumatic Stress Disorders0medium11
Poultry Diseases0low10
Pre B-ALL0low10
Pre-B ALL0low10
Pre-B-Cell Leukemia0low10
Precursor B-Cell Lymphoblastic Leukemia0low10
Precursor B-Cell Lymphoblastic Leukemia-Lymphoma0low10
Precursor B-Cell Lymphoblastic Lymphoma0low10
Pregnancy0medium342
Pregnancy Complications0medium51
Premature Beats0low10
Premature Cardiac Complex0low10
Premature Cardiac Complexes0low10
Premature Labor0low10
Premature Obstetric Labor0low10
Prenatal Exposure Delayed Effects0low30
Prescription Drug Abuse0low210
Prescription Opioid Abuse0medium11
Prescription Opioid Misuse0medium11
Presenile Alzheimer Dementia0low20
Preterm Labor0low10
Primary Adrenal Insufficiency0low10
Primary Adrenocortical Insufficiency0low10
Primary Brain Neoplasms0low10
Primary Hypersomnia Disorders0low30
Primary Hypersomnolence Disorders0low30
Primary Hyperthyroidism0low20
Primary Hypoadrenalism0low10
Primary Hypothyroidism0low10
Primary Insomnia0medium4413
Primary Malignant Brain Neoplasms0low10
Primary Malignant Brain Tumors0low10
Primary Parkinsonism0low20
Primary Peritonitis0low10
Primary Senile Degenerative Dementia0low20
Progressive Chorea, Chronic Hereditary (Huntington)0low10
Progressive Chorea, Hereditary, Chronic (Huntington)0low10
Progressive External Ophthalmoplegia0low10
Progressive Myoclonus Epilepsy 10low10
Progressive Myoclonus Epilepsybaltic Myoclonic Epilepsy0low10
Progressive Torsion Spasm0low10
Prothrombin Deficiency0low20
Pruritis0low20
Pruritus0low20
Pseudoakathisia0low20
Pseudoaphakia0medium72
Pseudocoma0low40
Pseudodystonia0low20
Pseudopelade0low20
Psoriasis0low10
Psychiatric Diagnosis0medium134
Psychiatric Diseases0medium134
Psychiatric Disorders0medium134
Psychiatric Illness0medium134
Psychomotor Agitation0medium51
Psychomotor Disorders0low10
Psychomotor Disorders, Developmental0low10
Psychomotor Hyperactivity0medium51
Psychomotor Impairment0low10
Psychomotor Restlessness0medium51
Psychoneuroses0medium31
Psychophysiologic Disorders0low30
Psychophysiological Disorders0low30
Psychophysiological Insomnia0medium4413
Psychoses0medium41
Psychoses, Alcoholic0medium82
Psychoses, Drug0low50
Psychoses, Manic-Depressive0medium11
Psychoses, Substance-Induced0low50
Psychoses, Toxic0low50
Psychoses, Traumatic0low20
Psychosis0medium41
Psychosis, Brief Reactive0medium41
Psychosis, Manic-Depressive0medium11
Psychosomatic Disorders0low30
Psychotic Disorders0medium41
PTSD0medium11
Pulmonary Atelectasis0low10
Pulmonary Cancer0low10
Pulmonary Cystic Fibrosis0low20
Pulmonary Disease0low20
Pulmonary Diseases0low20
Pulmonary Edema0low20
Pulmonary Edemas0low20
Pulmonary Embolism0low10
Pulmonary Embolisms0low10
Pulmonary Inflammation0medium31
Pulmonary Neoplasms0low10
Pulmonary Thromboembolism0low10
Pulmonary Thromboembolisms0low10
Purpura0low10
Pustular Psoriasis of Palms and Soles0low10
Pustulosis of Palms and Soles0low10
Pustulosis Palmaris et Plantaris0low10
Pyaemia0low10
Pyemia0low10
Pykno-Epilepsy0low20
Pyknolepsy0low20
Pyohemia0low10
Pyrexia0medium51
Pyrexial Convulsion0low30
Pyrexial Seizure0low30
Pyridoxine Deficiency0low10
Quadriparesis0low10
Quadriplegia0low10
Radiation Injuries0low10
Radiation Sickness0low10
Radiation Syndrome0low10
Raillietiniasis0low10
Rales0low20
Rash0low10
Rasmussen Encephalitis0low10
Rasmussen Syndrome0low10
Rasmussen's Syndrome0low10
Reactive Disorders0medium11
Reactive Hypoglycemia0low20
Rebound Insomnia0medium4413
Rebound Nystagmus0low10
Recrudescence0medium61
Recruitment, Loudness0low10
Recurrence0medium61
Reflex, Abnormal0medium31
Reflex, Absent0medium31
Reflex, Acoustic, Abnormal0medium31
Reflex, Anal, Absent0medium31
Reflex, Anal, Decreased0medium31
Reflex, Ankle, Abnormal0medium31
Reflex, Ankle, Absent0medium31
Reflex, Ankle, Decreased0medium31
Reflex, Biceps, Abnormal0medium31
Reflex, Biceps, Absent0medium31
Reflex, Biceps, Decreased0medium31
Reflex, Corneal, Absent0medium31
Reflex, Corneal, Decreased0medium31
Reflex, Decreased0medium31
Reflex, Deep Tendon, Abnormal0medium31
Reflex, Deep Tendon, Absent0medium31
Reflex, Gag, Absent0medium31
Reflex, Gag, Decreased0medium31
Reflex, Knee, Abnormal0medium31
Reflex, Knee, Decreased0medium31
Reflex, Moro, Asymmetric0medium31
Reflex, Pendular0medium31
Reflex, Triceps, Abnormal0medium31
Reflex, Triceps, Absent0medium31
Reflex, Triceps, Decreased0medium31
Reflexes, Abnormal0medium31
Reflux, Gastroesophageal0low10
Relapse0medium61
REM Sleep Deprivation0medium81
Renal Cancer0low10
Renal Disease, End-Stage0low10
Renal Failure, Acute0low10
Renal Failure, Chronic0low10
Renal Failure, End-Stage0low10
Renal Insufficiency, Acute0low10
Renal Neoplasms0low10
Reperfusion Damage0low10
Reperfusion Injury0low10
Resorption Atelectasis0low10
Resorption Pulmonary Atelectasis0low10
Respiration Disorders0low20
Respiratory Acidosis0low10
Respiratory Depression0low110
Respiratory Failure0low110
Respiratory Infections0low10
Respiratory Insufficiency0low110
Respiratory Sounds0low20
Respiratory Tract Infections0low10
Rest Tremor0medium32
Resting Tremor0medium32
Restless Leg Syndrome0low10
Restless Legs0low10
Restless Legs Syndrome0low10
Restlessness0medium51
Retardation, Mental0low50
Retinal Diseases0low10
Retinopathy of Prematurity0low10
Retraction Nystagmus0low10
Retro-Ocular Headache0low10
Retrolental Fibroplasia0low10
Rheumatic Heart Disease0low10
Rheumatism, Muscular0low10
Rheumatoid Arthritis0low10
Rhonchi0low20
Rhus Dermatitis0low10
Rhythmic Movement Disorders, Nocturnal0medium11
Right Bundle Branch Block, ST Segment Elevation, and Sudden Death Syndrome0low10
Right Hemisphere, Cerebral Infarction0low40
Right Hemisphere, Infarction, Cerebral0low40
Right Middle Cerebral Artery Infarction0low20
Right-Sided Heart Failure0low40
Rigidity, Decerebrate0low40
Rigidity, Decorticate0low40
Rigidity, Muscular0low10
Rodent Diseases0low20
Rotary Nystagmus0low10
Rotational Nystagmus0low10
Rotor Syndrome0low10
Rupture, Spontaneous0low10
SADDAN0low10
SADDAN Dysplasia0low10
Salaam Attacks0low20
Salaam Seizures0low20
Sarcoma, Engelbreth-Holm-Swarm0low10
Sarcoma, Experimental0low10
Sarcoma, Jensen0low10
Sarcomas, Experimental0low10
Saturnine Tremor0medium32
Scalded Skin Syndrome, Nonstaphylococcal0low10
Schistoma Infection0low10
Schistosomiasis0low10
Schizoaffective Disorder0medium41
Schizophrenia, Childhood0medium11
Schizophrenia, Disorganized0low10
Schizophrenia, Hebephrenic0low10
Schizophrenia, Paranoid0low10
Schizophrenic Disorders0medium125
Schizophreniform Catatonia0low10
Schizophreniform Disorders0medium41
Scholastic Skills Development Disorders0low10
Secondary Dystonia0low20
Secondary Hypersomnia Disorders0low30
Secondary Hypersomnolence Disorders0low30
Secondary Hypothyroidism0low10
Secondary Insomnia0medium4413
Secondary Parkinsonism0low30
Secondary Peritonitis0low10
Secondary Vascular Parkinson Disease0low30
See-Saw Nystagmus0low10
Segmental Autonomic Dysfunction0low10
Seizure0medium382
Seizure Disorder0medium211
Seizure Disorder, Absence0low20
Seizure Disorder, Grand Mal0low30
Seizure Disorder, Major Motor0low30
Seizure Disorder, Tonic Clonic0low30
Seizure, Febrile, Complex0low30
Seizure, Febrile, Simple0low30
Seizures0medium382
Seizures, Auditory0medium382
Seizures, Clonic0medium382
Seizures, Convulsive0medium382
Seizures, Epileptic0medium382
Seizures, Febrile0low30
Seizures, Focal0medium382
Seizures, Generalized0medium382
Seizures, Gustatory0medium382
Seizures, Motor0medium382
Seizures, Olfactory0medium382
Seizures, Sensory0medium382
Seizures, Somatosensory0medium382
Seizures, Tonic0medium382
Seizures, Tonic-Clonic0medium382
Seizures, Vertiginous0medium382
Seizures, Vestibular0medium382
Seizures, Visual0medium382
Semantic-Pragmatic Disorder0low10
Senile Dementia, Acute Confusional0low20
Senile Dementia, Alzheimer Type0low20
Senile Paranoid Dementia0medium21
Senile Tremor0medium32
Sensitivity and Specificity0medium141
Sensitivity, Contact0low20
Sensorineural Hearing Loss0medium31
Sepsis0low10
Septic Abortion0low10
Septic Shock0low20
Septicemia0low10
Serotonin Syndrome0low10
Serum Sickness0low10
Severe Achondroplasia with Developmental Delay and Acanthosis Nigricans0low10
Severe Infantile Myoclonic Epilepsy0low10
Severe Myoclonic Epilepsy Of Infancy0low10
Severe Myoclonic Epilepsy, Infantile0low10
Severe Sepsis0low10
Sharp Headache0low10
Sheep Diseases0low20
Shingles0low10
Shock0low10
Shock, Anaphylactic0low60
Shock, Endotoxic0low20
Shock, Septic0low20
Shock, Toxic0low20
Shock, Traumatic0low10
Short Sleep Phenotype0medium141
Short Sleeper Syndrome0medium141
Shortness of Breath0low20
Shoulder Girdle Neuropathy0low10
Shoulder-Girdle Neuropathy0low10
Sick Headache0medium134
Side Effects of Drugs0low90
Simple Partial Status Epilepticus0low80
Single Seizure0medium382
Skeleton-Skin-Brain Syndrome0low10
Skin and Subcutaneous Tissue Disorders0low10
Skin Diseases0low10
Skin Rash0low10
Sleep Apnea Hypopnea Syndrome0low10
Sleep Apnea Syndrome, Obstructive0low10
Sleep Apnea Syndromes0low40
Sleep Apnea, Mixed0low40
Sleep Apnea, Mixed Central and Obstructive0low40
Sleep Apnea, Obstructive0low10
Sleep Debt0medium81
Sleep Deprivation0medium81
Sleep Disorders0medium141
Sleep Fragmentation0medium81
Sleep Hypopnea0low40
Sleep Initiation and Maintenance Disorders0medium4413
Sleep Initiation Dysfunction0medium4413
Sleep Insufficiency0medium81
Sleep Starts0medium11
Sleep Talking0medium11
Sleep Wake Disorders0medium141
Sleep Walking0low40
Sleep Walking Disorder0low40
Sleep-Disordered Breathing0low40
Sleep-Related Neurogenic Tachypnea0medium141
Sleep-Wake Transition Disorders0medium11
Sleep-Wake Transitional Disorders0medium11
Sleeplessness0medium4413
Sleepwalking0low40
Somnambulism0low40
Somnolescent Starts0medium11
Spasmodic Croup0low20
Spasms, Infantile0low20
Spasmus Nutans0low20
Spastic Paraplegia0low10
Spastic Quadriplegia0low10
Spastic Tetraplegia0low10
Speech Delay0low10
Speech or Language, Developmental Disorder0low10
Spinal Cord Contusion0low30
Spinal Cord Diseases0low10
Spinal Cord Disorders0low10
Spinal Cord Injuries0low30
Spinal Cord Laceration0low30
Spinal Cord Transection0low30
Spinal Cord Trauma0low30
Spinal Diseases0low10
Spinal Fractures0low10
Splenomegaly0low10
Spontaneous Ocular Nystagmus0low10
Squint0low10
SREDIu0160NJI u017DIVu010CANI SUSTAV, BOLESTI@hr0low10
Starvation0low10
Static Tremor0medium32
Status Asthmaticus0low10
Status Epilepticus0low80
Status Epilepticus, Complex Partial0low80
Status Epilepticus, Electrographic0low80
Status Epilepticus, Generalized0low80
Status Epilepticus, Generalized Convulsive0low80
Status Epilepticus, Grand Mal0low80
Status Epilepticus, Non-Convulsive0low80
Status Epilepticus, Simple Partial0low80
Status Epilepticus, Subclinical0low80
Status Marmoratus0medium11
Status Migrainosus0medium134
Stenosis, Esophageal0low20
Stevens Johnson Syndrome Toxic Epidermal Necrolysis0low10
Stevens Johnson Syndrome Toxic Epidermal Necrolysis Spectrum0low10
Stevens-Johnson Syndrome0low10
Stevens-Johnson Syndrome Toxic Epidermal Necrolysis0low10
Stevens-Johnson Syndrome Toxic Epidermal Necrolysis Spectrum0low10
Stimulus Deprivation-Induced Amblyopia0low20
Stomach Diseases0low20
Stomach Fistula0low20
Stomach Rupture0low10
Stomach Ulcer0low30
Strabismus0low10
Strabismus, Comitant0low10
Strabismus, Noncomitant0low10
Streptozocin Diabetes0low10
Streptozotocin Diabetes0low10
Stress Disorder, Post Traumatic0medium11
Stress Disorders, Post-Traumatic0medium11
Stress Disorders, Posttraumatic0medium11
Stridor0low20
Stroke0low30
Stroke, Acute0low30
Stroke, Middle Cerebral Artery0low20
Subacute Delirium0medium31
Subacute Necrotizing Encephalomyelitis, Infantile0low10
Subacute Necrotizing Encephalomyelopathy0low10
Subacute Necrotizing Encephalopathy0low10
Subacute Necrotizing Encephalopathy, Infantile0low10
Subacute Necrotizing Encephalopathy, Juvenile0low10
Subcortical Infarction0low40
Substance Abuse0low210
Substance Addiction0low210
Substance Dependence0low210
Substance Use0low210
Substance Use Disorders0low210
Substance Withdrawal Syndrome0medium244
Substance Withdrawal, Neonatal0medium21
Substance-Induced Psychoses0low50
Substance-Related Disorders0low210
Subwakefullness Syndrome0medium141
Sudden Death0low10
Sudden Unexplained Death Syndrome0low10
Sudden Unexplained Nocturnal Death Syndrome0low10
Sudden Unexplained Nocturnal Death Syndrome (SUNDS)0low10
Suffering, Physical0medium122
Suffocation0low10
Superficial Head Injury0low10
Supravalvar Aortic Stenosis Syndrome0low10
Surgery-Induced Tissue Adhesions0low10
Surgical Adhesions0low10
Surgical Site Infection0low20
Surgical Wound Infection0low20
Susceptibility, Disease0low10
Sykdommer i sentralnervesystemet@no0low10
Sympathetic Nervous System Diseases0low10
Symptom Cluster0low50
Symptomatic Infantile Spasms0low20
Symptomatic Myoclonic Epilepsy0low10
Symptomatic Nystagmus0low10
Symptomatic Parkinson Disease0low30
Symptomatic Tonic-Clonic Epilepsy0low30
Symptomatic West Syndrome0low20
Syndrome0low50
Syndrome, Obstructive Sleep Apnea0low10
Syndrome, Sleep Apnea, Obstructive0low10
Syndrome, Upper Airway Resistance, Sleep Apnea0low10
Systemic Lupus Erythematosus0low20
Tachyarrhythmia0low80
Tachycardia0low80
Tachycardia, Paroxysmal0low10
Tachycardia, Ventricular0low10
Tactile Allodynia0low10
Tapeworm Infection0low10
Temporal Region Trauma0low10
Temporary Nystagmus0low10
Testes, Undescended0low10
Testis, Undescended0low10
Tetanus0low120
Tetraplegia0low10
Thermal Allodynia0low10
Throbbing Headache0low10
Thromboembolism, Pulmonary0low10
Thromboembolisms, Pulmonary0low10
Thrombophlebitis0medium11
Thrombosis, Middle Cerebral Artery0low20
Thrombotic Infarction, Middle Cerebral Artery0low20
Thyroid-Stimulating Hormone Deficiency0low10
TIA (Transient Ischemic Attack)0low50
Tissue Adhesions0low10
Todd Paralysis0low30
Todd's Paralysis0low30
Tonic Clonic Convulsions0low30
Tonic Clonic Seizure0medium382
Tonic Seizure0medium382
Tonic Seizures0medium382
Tonic-Clonic Convulsion Disorder0low30
Tonic-Clonic Convulsion Syndrome0low30
Tonic-Clonic Seizure0medium382
Tonic-Clonic Seizure Disorder0low30
Tonic-Clonic Seizure Syndrome0low30
Tonic-Clonic Seizures0medium382
Torsion Abnormality0low10
Torsion Disease of Childhood0low10
Torsion Dystonia0low10
Toxic Epidermal Necrolysis0low10
Toxic Epidermal Necrolysis Stevens Johnson Syndrome0low10
Toxic Epidermal Necrolysis Stevens Johnson Syndrome Spectrum0low10
Toxic Epidermal Necrolysis Stevens-Johnson Syndrome0low10
Toxic Epidermal Necrolysis Stevens-Johnson Syndrome Spectrum0low10
Toxic Hepatitis0low100
Toxic Psychoses0low50
Toxic Shock0low20
Toxic Shock Syndrome0low20
Toxicity, Drug0low90
Toxicodendron Dermatitis0low10
Tracheal Stenosis0low10
Transformation, Neoplastic Cell0low10
Transient Insomnia0medium4413
Transient Ischemic Attack0low50
Transient Ischemic Attack, Anterior Circulation0low50
Transient Ischemic Attack, Brain Stem0low50
Transient Ischemic Attack, Brainstem0low50
Transient Ischemic Attack, Carotid Circulation0low50
Transient Ischemic Attack, Posterior Circulation0low50
Transient Ischemic Attack, Vertebrobasilar Circulation0low50
Transient Ischemic Attacks, Crescendo0low50
Transient Situational Disturbance0medium11
Transition Disorders, Sleep-Wake0medium11
Transitional Disorders, Sleep-Wake0medium11
Transitory Hearing Loss0low10
Trauma, Head0low10
Tremor0medium32
Tremor, Limb0medium32
Tremor, Muscle0medium32
Tremor, Neonatal0medium32
Tremor, Nerve0medium32
Tremor, Perioral0medium32
Tremor, Semirhythmic0medium32
Trismus0low10
Trisomy 210low10
Trisomy 21, Meiotic Nondisjunction0low10
Trisomy 21, Mitotic Nondisjunction0low10
Trisomy G0low10
TSH Deficiency0low10
Tuberculosis0low10
Tumorigenic Transformation0low10
Tumors0low90
Type 1 Diabetes0low10
Type 1 Diabetes Mellitus0low10
Type I Hypersensitivity0low10
u041Du0415u0420u0412u041Du041Eu0419 u0421u0418u0421u0422u0415u041Cu042B u0426u0415u041Du0422u0420u0410u041Bu042Cu041Du041Eu0419 u0411u041Eu041Bu0415u0417u041Du0418@ru0low10
u4E2Du67A2u795Eu7D4Cu7CFBu75BEu60A3@ja0low10
Ulcer0low20
Umbilical Hernia0low10
Unconscious State0medium21
Unconsciousness0medium21
Undescended Testis0low10
Unidirectional Nystagmus0low10
Unilateral Cryptorchidism0low10
Unilateral Headache0low10
Unipolar Depression0low20
Unverricht Disease0low10
Unverricht-Lundborg Disease0low10
Unverricht-Lundborg Syndrome0low10
Upper Airway Resistance Sleep Apnea Syndrome0low10
Upper Respiratory Infections0low10
Upper Respiratory Tract Infection0low10
Upper Respiratory Tract Infections0low10
Urticaria0low10
Vaginal Discharge0low10
Vaginal Diseases0low10
Valvular Heart Diseases0medium11
Vascular Accident, Brain0low30
Vascular Diseases, Peripheral0low10
Vascular Headache0low10
Vascular Headaches0low10
Vascular Hypotension0medium91
Vasogenic Brain Edema0low20
Vasogenic Cerebral Edema0low20
Ventilatory Depression0low110
Ventricular Fibrillation0low20
Ventricular Septal Defect0low10
Ventricular Septal Defects0low10
Ventricular Tachyarrhythmias0low10
Ventricular Tachycardia0low10
Verruca0low10
Vertebrobasilar Circulation Transient Ischemic Attack0low50
Vertex Headache0low10
Vertical Nystagmus0low10
Veterinary Abortion0low20
Vibrio cholerae Infection0low10
Viral Croup0low20
Vitamin B 12 Deficiency0low20
Vitamin B 6 Deficiency0low10
Vitamin B12 Deficiency0low20
Vitamin B6 Deficiency0low10
Vitamin C Deficiency0low10
Vitamin Deficiency, B60low10
Vomiting0medium113
Vomiting, Postoperative0low20
Warts0low10
Water-Electrolyte Imbalance0low10
Weight Gain0low10
West Syndrome0low20
Wet Lung0low20
Wheezing0low20
White Spot, Dental0low10
White Spots, Dental0low10
Whooping Cough0low10
Williams Contiguous Gene Syndrome0low10
Williams Syndrome0low10
Williams-Beuren Syndrome0low10
Willis Ekbom Disease0low10
Willis Ekbom Syndrome0low10
Willis-Ekbom Disease0low10
Willis-Ekbom Syndrome0low10
Withdrawal Symptoms0medium244
Wittmaack Ekbom Syndrome0low10
Wittmaack-Ekbom Syndrome0low10
Wound Infection, Postoperative0low20
Wound Infection, Surgical0low20
Wounds, Gunshot0low20
Writer's Cramp0low20
X-Linked Mental Retardation and Macroorchidism0low10
Xerostomia0medium11
Yersinia enterocolitica Infection0low10
Yersinia Infection0low10
Yersinia Infections0low10
Yersiniosis0low10
Zentralnervensystemkrankheiten@de0low10
Ziekte, centraalzenuwstelsel-@nl0low10
Zika Fever0low10
Zika Virus Disease0low10
Zika Virus Infection0low10
ZikV Infection0low10
Zona0low10
Zoster0low10

Research Highlights

Safety/Toxicity (60)

ArticleYear
Safety and efficacy of pediatric sedation protocol for diagnostic examination in a pediatric emergency room: A retrospective study.
Medicine, Jun-23, Volume: 102, Issue: 25		2023
Revisiting the effect of boiling on halogenated disinfection byproducts, total organic halogen, and cytotoxicity in simulated tap water.
Chemosphere, Volume: 309, Issue: Pt 1		2022
Efficacy and safety of intranasal dexmedetomidine versus oral chloral hydrate as sedatives for pediatric patients: a systematic review and meta-analysis.
Journal of investigative medicine : the official publication of the American Federation for Clinical Research, Volume: 70, Issue: 5		2022
Acute toxicity of disinfection by-products from chlorination of algal organic matter to the cladocerans Ceriodaphnia silvestrii and Daphnia similis: influence of bromide and quenching agent.
Environmental science and pollution research international, Volume: 29, Issue: 24		2022
Comparative safety profile of chloral hydrate versus other sedatives for procedural sedation in hospitalized infants.
Journal of neonatal-perinatal medicine, Volume: 13, Issue: 2		2020
Systematic review and meta-analysis found that intranasal dexmedetomidine was a safe and effective sedative drug during paediatric procedural sedation.
Acta paediatrica (Oslo, Norway : 1992), Volume: 109, Issue: 10		2020
Safety and effectiveness of chloral hydrate in outpatient paediatric sedation for objective hearing tests.
International journal of pediatric otorhinolaryngology, Volume: 126		2019
Chloral Hydrate Administered by a Dedicated Sedation Service Can Be Used Safely and Effectively for Pediatric Ophthalmic Examination.
American journal of ophthalmology, Volume: 192		2018
Safety and Efficacy of Chloral Hydrate Sedation in Paediatric Sedation for Ophthalmic Procedures.
Annals of the Academy of Medicine, Singapore, Volume: 46, Issue: 4		2017
Safety and efficacy of chloral hydrate for procedural sedation in paediatric ophthalmology: a systematic review and meta-analysis.
The British journal of ophthalmology, Volume: 101, Issue: 10		2017
Safety and efficacy of chloral hydrate for conscious sedation of infants in the pediatric cardiovascular intensive care unit.
Medicine, Volume: 96, Issue: 1		2017
Assessing the genotoxicity of two commonly occurring byproducts of water disinfection: Chloral hydrate and bromal hydrate.
Mutation research. Genetic toxicology and environmental mutagenesis, Volume: 813		2017
[Preclinical safety evaluation of chloral hydrate after topical application using the example of psoriatic itch].
Der Hautarzt; Zeitschrift fur Dermatologie, Venerologie, und verwandte Gebiete, Volume: 68, Issue: 3		2017
Efficacy and safety of chloral hydrate sedation in infants for pulmonary function tests.
Revista paulista de pediatria : orgao oficial da Sociedade de Pediatria de Sao Paulo, Volume: 34, Issue: 4		2016
Chloral hydrate sedation for auditory brainstem response (ABR) testing in children: Safety and effectiveness.
International journal of pediatric otorhinolaryngology, Volume: 83		2016
Paediatric sedation for imaging is safe and effective in a district general hospital.
The British journal of radiology, Volume: 89, Issue: 1061		2016
Oral Sedation Postdischarge Adverse Events in Pediatric Dental Patients.
Anesthesia progress,Fall, Volume: 62, Issue: 3		2015
Utilisation of an outpatient sedation unit in paediatric ophthalmology: safety and effectiveness of chloral hydrate in 1509 sedation episodes.
The British journal of ophthalmology, Volume: 97, Issue: 11		2013
Post-discharge adverse events following pediatric sedation with high doses of oral medication.
The Journal of pediatrics, Volume: 160, Issue: 5		2012
A comparison of the efficacy and safety of chloral hydrate versus inhaled anesthesia for sedating infants and toddlers for transthoracic echocardiograms.
Journal of the American Society of Echocardiography : official publication of the American Society of Echocardiography, Volume: 23, Issue: 1		2010
Evidence of safety of chloral hydrate for prolonged sedation in PICU in a tertiary teaching hospital in southern Brazil.
European journal of clinical pharmacology, Volume: 65, Issue: 12		2009
Chloral hydrate sedation for pediatric echocardiography: physiologic responses, adverse events, and risk factors.
Pediatrics, Volume: 117, Issue: 3		2006
The assessment of genotoxic effects in lymphocyte cultures of infants treated with chloral hydrate.
Mutation research, Dec-12, Volume: 564, Issue: 2		2004
Preprocedural fasting state and adverse events in children undergoing procedural sedation and analgesia in a pediatric emergency department.
Annals of emergency medicine, Volume: 42, Issue: 5		2003
Is administration of enteric contrast material safe before abdominal CT in children who require sedation? Experience with chloral hydrate and pentobarbital.
AJR. American journal of roentgenology, Volume: 180, Issue: 1		2003
Mixture toxicity of priority pollutants at no observed effect concentrations (NOECs).
Ecotoxicology (London, England), Volume: 11, Issue: 5		2002
Metabolism and toxicity of trichloroethylene in epididymis and testis.
Toxicology and applied pharmacology, Aug-01, Volume: 182, Issue: 3		2002
Adverse events and outcomes of conscious sedation for pediatric patients: study of an oral sedation regimen.
Journal of the American Dental Association (1939), Volume: 132, Issue: 11		2001
NTP technical report on the toxicity and metabolism studies of chloral hydrate (CAS No. 302-17-0). Administered by gavage to F344/N rats and B6C3F1 mice.
Toxicity report series, Issue: 59		1999
Is sedation safe during dynamic sleep fluoroscopy of children with obstructive sleep apnea?
AJR. American journal of roentgenology, Volume: 177, Issue: 5		2001
Trained nurses can provide safe and effective sedation for MRI in pediatric patients.
Canadian journal of anaesthesia = Journal canadien d'anesthesie, Volume: 47, Issue: 3		2000
Prolonged recovery and delayed side effects of sedation for diagnostic imaging studies in children.
Pediatrics, Volume: 105, Issue: 3		2000
Metabolism and toxicity of trichloroethylene and S-(1,2-dichlorovinyl)-L-cysteine in freshly isolated human proximal tubular cells.
Toxicological sciences : an official journal of the Society of Toxicology, Volume: 53, Issue: 2		2000
A survey of post-discharge side effects of conscious sedation using chloral hydrate in pediatric CT and MR imaging.
Pediatric radiology, Volume: 29, Issue: 4		1999
Adverse events and risk factors associated with the sedation of children by nonanesthesiologists.
Anesthesia and analgesia, Volume: 85, Issue: 6		1997
Safety and efficacy of sedation in children using a structured sedation program.
AJR. American journal of roentgenology, Volume: 168, Issue: 5		1997
Safe pediatric outpatient sedation: the chloral hydrate debate revisited.
Otolaryngology--head and neck surgery : official journal of American Academy of Otolaryngology-Head and Neck Surgery, Volume: 116, Issue: 1		1997
Developmental toxicity of trichloroethylene, tetrachloroethylene and four of their metabolites in rat whole embryo culture.
Archives of toxicology, Volume: 70, Issue: 2		1995
Safety and efficacy of chloral hydrate sedation in children undergoing echocardiography.
The Journal of pediatrics, Volume: 129, Issue: 2		1996
Chloral hydrate toxicity from oral and intravenous administration.
Journal of toxicology. Clinical toxicology, Volume: 34, Issue: 1		1996
An audit of adverse events in children sedated with chloral hydrate or propofol during imaging studies.
Paediatric anaesthesia, Volume: 5, Issue: 6		1995
Genotoxicity assay of chloral hydrate and chloropicrine.
Mutation research, Volume: 348, Issue: 4		1995
High-dose chloral hydrate sedation for children undergoing MR imaging: safety and efficacy in relation to age.
AJR. American journal of roentgenology, Volume: 161, Issue: 3		1993
Chloral hydrate sedation of children undergoing CT and MR imaging: safety as judged by American Academy of Pediatrics guidelines.
AJR. American journal of roentgenology, Volume: 165, Issue: 4		1995
Efficacy and side effects of chloral hydrate and tryptophan as sleeping aids in psychogeriatric patients.
International pharmacopsychiatry, Volume: 15, Issue: 2		1980
Chloral hydrate toxicity in a preterm infant.
Pediatric pharmacology (New York, N.Y.), Volume: 4, Issue: 3		1984
Effects of diiospropyl-1,3-dithiol-2-ylidene malonate (NKK-105) on acute toxicity of various drugs and heavy metals.
The Journal of toxicological sciences, Volume: 7, Issue: 2		1982
MMS-induced primary aneuploidy and other genotoxic effects in mitotic cells of Aspergillus.
Mutation research, Volume: 201, Issue: 2		1988
Pediatric oral premedication: changes in the patterns of administration and safety.
Compendium (Newtown, Pa.), Volume: 10, Issue: 10		1989
Chloral hydrate anesthesia antagonizes the neurotoxicity of 3,4-methylenedioxymethamphetamine.
European journal of pharmacology, Nov-27, Volume: 191, Issue: 2		1990
Chloral hydrate toxicity in a term infant.
Developmental pharmacology and therapeutics, Volume: 17, Issue: 1-2		1991
Ninety-day toxicity study of chloral hydrate in the Sprague-Dawley rat.
Drug and chemical toxicology, Volume: 15, Issue: 3		1992
Importance of pharmacokinetic studies on cyclophosphamide (NSC-26271) in understanding its cytotoxic effect.
Cancer treatment reports, Volume: 60, Issue: 4		1976
[information is derived through text-mining from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Long-term Use (2)

ArticleYear
Ethanol withdrawal does not induce a reduction in the number of spontaneously active dopaminergic neurons in the mesolimbic system.
Brain research, Jun-05, Volume: 682, Issue: 1-2		1995
[information is derived through text-mining from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Pharmacokinetics (15)

ArticleYear
Pharmacokinetic interaction between methotrexate and chloral hydrate.
Pediatric blood & cancer, Volume: 60, Issue: 3		2013
Micro liquid-liquid extraction combined with large-volume injection gas chromatography-mass spectrometry for the determination of haloacetaldehydes in treated water.
Journal of chromatography. A, Nov-18, Volume: 1218, Issue: 46		2011
Bayesian population analysis of a harmonized physiologically based pharmacokinetic model of trichloroethylene and its metabolites.
Regulatory toxicology and pharmacology : RTP, Volume: 46, Issue: 1		2006
Pharmacodynamics of chloral hydrate in former preterm infants.
European journal of pediatrics, Volume: 164, Issue: 7		2005
Chloral hydrate and ethanol, but not urethane, alter the clearance of exogenous dopamine recorded by chronoamperometry in striatum of unrestrained rats.
Neuroscience letters, May-29, Volume: 343, Issue: 1		2003
Effect of enterohepatic circulation on the pharmacokinetics of chloral hydrate and its metabolites in F344 rats.
Journal of toxicology and environmental health. Part A, Jul-09, Volume: 57, Issue: 5		1999
Physiologically based pharmacokinetic modeling of inhaled trichloroethylene and its oxidative metabolites in B6C3F1 mice.
Toxicology and applied pharmacology, Feb-01, Volume: 154, Issue: 3		1999
Influence of tidal volume and positive end-expiratory pressure on inspiratory gas distribution and gas exchange during mechanical ventilation in horses positioned in lateral recumbency.
American journal of veterinary research, Volume: 59, Issue: 3		1998
[The relative bioavailability and pharmacokinetics of chloral hydrate and its metabolites].
Arzneimittel-Forschung, Volume: 48, Issue: 1		1998
A physiologically based pharmacokinetic model for trichloroethylene and its metabolites, chloral hydrate, trichloroacetate, dichloroacetate, trichloroethanol, and trichloroethanol glucuronide in B6C3F1 mice.
Toxicology and applied pharmacology, Volume: 147, Issue: 1		1997
Pharmacokinetic analysis of chloral hydrate and its metabolism in B6C3F1 mice.
Drug metabolism and disposition: the biological fate of chemicals, Volume: 24, Issue: 12		1996
Pharmacokinetics of chloral hydrate poisoning treated with hemodialysis and hemoperfusion.
Acta medica Scandinavica, Volume: 223, Issue: 3		1988
Methodological aspects of flow-volume studies in infants.
Pediatric pulmonology, Volume: 8, Issue: 4		1990
Importance of pharmacokinetic studies on cyclophosphamide (NSC-26271) in understanding its cytotoxic effect.
Cancer treatment reports, Volume: 60, Issue: 4		1976
[information is derived through text-mining from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Bioavailability (8)

ArticleYear
A High-Throughput Screen of a Library of Therapeutics Identifies Cytotoxic Substrates of P-glycoprotein.
Molecular pharmacology, Volume: 96, Issue: 5		2019
Physiologically relevant orthogonal assays for the discovery of small-molecule modulators of WIP1 phosphatase in high-throughput screens.
The Journal of biological chemistry, 11-15, Volume: 294, Issue: 46		2019
[Preclinical safety evaluation of chloral hydrate after topical application using the example of psoriatic itch].
Der Hautarzt; Zeitschrift fur Dermatologie, Venerologie, und verwandte Gebiete, Volume: 68, Issue: 3		2017
[The relative bioavailability and pharmacokinetics of chloral hydrate and its metabolites].
Arzneimittel-Forschung, Volume: 48, Issue: 1		1998
[The plasma level of the neurotoxin 1-trichloromethyl-1,2,4,5-tetrahydro-beta-carboline (TaClo) in man after oral administration of chloral hydrate].
Arzneimittel-Forschung, Volume: 48, Issue: 1		1998
Electromagnetic millimeter waves increase the duration of anaesthesia caused by ketamine and chloral hydrate in mice.
International journal of radiation biology, Volume: 72, Issue: 4		1997
Chloral hydrate toxicity from oral and intravenous administration.
Journal of toxicology. Clinical toxicology, Volume: 34, Issue: 1		1996
The cholecystohepatic circulation of trichloroethylene and its metabolites in dogs.
Toxicology, Volume: 44, Issue: 3		1987
[information is derived through text-mining from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Dosage (74)

ArticleYear
Safety and efficacy of pediatric sedation protocol for diagnostic examination in a pediatric emergency room: A retrospective study.
Medicine, Jun-23, Volume: 102, Issue: 25		2023
Nasal drip of dexmedetomidine for optimal sedation during PICC insertion in pediatric burn care.
Medicine, Feb-10, Volume: 102, Issue: 6		2023
Needle-free pharmacological sedation techniques in paediatric patients for imaging procedures: a systematic review and meta-analysis.
British journal of anaesthesia, Volume: 130, Issue: 1		2023
Comparisons of Varying Dosages of Chloral Hydrate-Hydroxyzine with and without Meperidine for Managing Challenging Pediatric Dental Behavior: A Retrospective study of 35 years of Sedation Experiences.
The Journal of clinical pediatric dentistry, Jul-01, Volume: 46, Issue: 4		2022
Simple method to detect triclofos and its metabolites in plasma of children by combined use of liquid chromatography tandem-mass spectrometry and gas chromatography-mass spectrometry.
Scientific reports, 06-26, Volume: 9, Issue: 1		2019
Sedation of children undergoing dental treatment.
The Cochrane database of systematic reviews, 12-17, Volume: 12		2018
Photolysis of chloral hydrate in water with 254 nm ultraviolet: Kinetics, influencing factors, mechanisms, and products.
Chemosphere, Volume: 218		2019
Chlorpromazine dose for people with schizophrenia.
The Cochrane database of systematic reviews, 04-13, Volume: 4		2017
Chloral hydrate sedation for auditory brainstem response (ABR) testing in children: Safety and effectiveness.
International journal of pediatric otorhinolaryngology, Volume: 83		2016
Comparison of rescue techniques for failed chloral hydrate sedation for magnetic resonance imaging scans--additional chloral hydrate vs intranasal dexmedetomidine.
Paediatric anaesthesia, Volume: 26, Issue: 3		2016
Chloral hydrate, through biotransformation to dichloroacetate, inhibits maleylacetoacetate isomerase and tyrosine catabolism in humans.
Drug metabolism and personalized therapy, Volume: 30, Issue: 1		2015
Treatment of neonatal abstinence syndrome in preterm and term infants.
Klinische Padiatrie, Volume: 225, Issue: 5		2013
Increased anesthesia time using 2,2,2-tribromoethanol-chloral hydrate with low impact on mouse psychoacoustics.
Journal of neuroscience methods, Sep-30, Volume: 219, Issue: 1		2013
Prospective clinical audit of chloral hydrate administration practices in a neonatal unit.
Journal of paediatrics and child health, Volume: 48, Issue: 11		2012
Sedation of children undergoing dental treatment.
The Cochrane database of systematic reviews, Mar-14, Issue: 3		2012
Cardiac arrhythmias induced by chloral hydrate in rhesus monkeys.
Cardiovascular toxicology, Volume: 11, Issue: 2		2011
Practical oral sedation in dentistry. Part II--Clinical application of various oral sedatives and discussion.
Compendium of continuing education in dentistry (Jamesburg, N.J. : 1995), Volume: 27, Issue: 9		2006
Bayesian population analysis of a harmonized physiologically based pharmacokinetic model of trichloroethylene and its metabolites.
Regulatory toxicology and pharmacology : RTP, Volume: 46, Issue: 1		2006
Severe esophageal burn following chloral hydrate overdose in an infant.
Journal of the Formosan Medical Association = Taiwan yi zhi, Volume: 105, Issue: 3		2006
Short-term chloral hydrate administration and cancer in humans.
Drug safety, Volume: 29, Issue: 1		2006
Chloral hydrate. An effective agent for sedation in children with age and weight dependent response.
Saudi medical journal, Volume: 26, Issue: 5		2005
Influence of different anaesthetics on pro-inflammatory cytokine expression in rat spleen.
Laboratory animals, Volume: 38, Issue: 3		2004
Toxicokinetics of chloral hydrate in ad libitum-fed, dietary-controlled, and calorically restricted male B6C3F1 mice following short-term exposure.
Toxicology and applied pharmacology, Dec-01, Volume: 193, Issue: 2		2003
Toxicology and carcinogenesis study of chloral hydrate (ad libitum and dietary controlled) (CAS no. 302-17-0) in male B6C3F1 mice (gavage study).
National Toxicology Program technical report series, Issue: 503		2002
Tumorigenicity of chloral hydrate, trichloroacetic acid, trichloroethanol, malondialdehyde, 4-hydroxy-2-nonenal, crotonaldehyde, and acrolein in the B6C3F(1) neonatal mouse.
Cancer letters, Nov-08, Volume: 185, Issue: 1		2002
NTP Technical Report on the Toxicology and Carcinogenesis Studies of Chloral Hydrate (Cas No. 302-17-0) in B6C3F1 mice (Gavage Studies).
National Toxicology Program technical report series, Issue: 502		2002
NTP technical report on the toxicity and metabolism studies of chloral hydrate (CAS No. 302-17-0). Administered by gavage to F344/N rats and B6C3F1 mice.
Toxicity report series, Issue: 59		1999
Sedation of children for electroencephalograms.
Pediatrics, Volume: 108, Issue: 1		2001
Chloralhydrate in children undergoing echocardiography.
Indian journal of pediatrics, Volume: 68, Issue: 4		2001
Adverse sedation events in pediatrics: analysis of medications used for sedation.
Pediatrics, Volume: 106, Issue: 4		2000
Chloral hydrate versus midazolam for sedation of children for neuroimaging: a randomized clinical trial.
Pediatric emergency care, Volume: 16, Issue: 1		2000
The extent of dichloroacetate formation from trichloroethylene, chloral hydrate, trichloroacetate, and trichloroethanol in B6C3F1 mice.
Toxicological sciences : an official journal of the Society of Toxicology, Volume: 45, Issue: 1		1998
Studies on the mutagenic and carcinogenic potential of chloral hydrate.
Arzneimittel-Forschung, Volume: 48, Issue: 10		1998
Metabolism of chloral hydrate in mice and rats after single and multiple doses.
Journal of toxicology and environmental health. Part A, Jun-12, Volume: 54, Issue: 3		1998
A physiologically based pharmacokinetic model for trichloroethylene and its metabolites, chloral hydrate, trichloroacetate, dichloroacetate, trichloroethanol, and trichloroethanol glucuronide in B6C3F1 mice.
Toxicology and applied pharmacology, Volume: 147, Issue: 1		1997
Selectivity in the generalization profile in baboons trained to discriminate lorazepam: benzodiazepines, barbiturates and other sedative/anxiolytics.
The Journal of pharmacology and experimental therapeutics, Volume: 282, Issue: 3		1997
[Efficacy of rectal diazepam suppository in the prophylaxis of febrile seizures: comparison with rectal chloral hydrate suppository].
No to hattatsu = Brain and development, Volume: 29, Issue: 4		1997
Pharmacokinetic analysis of chloral hydrate and its metabolism in B6C3F1 mice.
Drug metabolism and disposition: the biological fate of chemicals, Volume: 24, Issue: 12		1996
Safety and efficacy of chloral hydrate sedation in children undergoing echocardiography.
The Journal of pediatrics, Volume: 129, Issue: 2		1996
[Chloral hydrate--is it safe?].
Harefuah, Jan-01, Volume: 130, Issue: 1		1996
Should chloral hydrate be banned?
Pediatrics, Volume: 92, Issue: 3		1993
Chloral hydrate sedation of children undergoing CT and MR imaging: safety as judged by American Academy of Pediatrics guidelines.
AJR. American journal of roentgenology, Volume: 165, Issue: 4		1995
Chloral hydrate overdose and cardiac arrhythmias.
Chest, Volume: 77, Issue: 2		1980
Toxicology of chloral hydrate in the mouse.
Environmental health perspectives, Volume: 44		1982
The choice of sedation for computed tomography in children: a prospective evaluation.
Radiology, Volume: 143, Issue: 2		1982
The effect of dietary protein quantity on the activity of UDP-glucuronyltransferase and its physiological significance in drug metabolism.
Canadian journal of physiology and pharmacology, Volume: 60, Issue: 12		1982
Problems of medication with the pediatric patient.
Dental clinics of North America, Volume: 28, Issue: 3		1984
Contribution of hypothermia to effects of chloral hydrate on flash evoked potentials of hooded rats.
Pharmacology, biochemistry, and behavior, Volume: 21, Issue: 4		1984
Analysis of mouse metaphase II oocytes as an assay for chemically induced aneuploidy.
Mutation research, Volume: 198, Issue: 1		1988
Effect of chloral hydrate on arterial oxygen saturation in wheezy infants.
Pediatric pulmonology, Volume: 5, Issue: 2		1988
Death after chloral hydrate sedation: report of case.
Journal of the American Dental Association (1939), Volume: 116, Issue: 3		1988
Chloral hydrate sedation in neonates and infants--clinical and pharmacologic considerations.
Developmental pharmacology and therapeutics, Volume: 12, Issue: 2		1989
Repeated haloperidol administration changes basal release of striatal dopamine and subsequent response to haloperidol challenge.
Brain research, Apr-10, Volume: 484, Issue: 1-2		1989
Efficacy of sedation of children with chloral hydrate.
Southern medical journal, Volume: 83, Issue: 9		1990
Gastric mucosal injury induced by chloral hydrate.
Toxicology letters, Volume: 52, Issue: 2		1990
Acute dystonia during fixed-dose neuroleptic treatment.
Journal of clinical psychopharmacology, Volume: 10, Issue: 6		1990
Sedation of children for technical procedures: current standard of practice.
Clinical pediatrics, Volume: 31, Issue: 3		1992
Distinguishing effects of cocaine i.v. and SC on mesoaccumbens dopamineand serotonin release with chloral hydrate anesthesia.
Pharmacology, biochemistry, and behavior, Volume: 43, Issue: 3		1992
Central action of drugs acting on the cholinergic muscarinic receptor. III. Influence of atropine and scopolamine injected intraventricularly on behavior and levels of biogenic amines in the rat brain.
Archivum immunologiae et therapiae experimentalis, Volume: 23, Issue: 4		1975
Determination of trichloroethanol at therapeutic and overdose levels in blood and urine by electron capture gas chromatography.
Journal of chromatography, Apr-09, Volume: 107, Issue: 1		1975
Effects of morphine on central catecholamine turnover, blood pressure and heart rate in the rat.
Naunyn-Schmiedeberg's archives of pharmacology, Volume: 294, Issue: 2		1976
Premedication in children undergoing day-care surgery.
British journal of anaesthesia, Volume: 51, Issue: 11		1979
[information is derived through text-mining from research data collected from National Library of Medicine (NLM), extracted Dec-2023]

Interactions (5)

ArticleYear
Micro liquid-liquid extraction combined with large-volume injection gas chromatography-mass spectrometry for the determination of haloacetaldehydes in treated water.
Journal of chromatography. A, Nov-18, Volume: 1218, Issue: 46		2011
Drug interactions in psychopharmacology.
The Psychiatric clinics of North America, Volume: 7, Issue: 3		1984
Approaches to the study of drug interactions in behavioral pharmacology.
Neuroscience and biobehavioral reviews,Summer, Volume: 10, Issue: 2		1986
Isobolographic characterization of drug interactions incorporating biological variability.
The Journal of pharmacology and experimental therapeutics, Volume: 252, Issue: 1		1990
[information is derived through text-mining from research data collected from National Library of Medicine (NLM), extracted Dec-2023]