Substance | Description | Relationhip Strength | Studies | Trials | Classes | Roles |
fluorescein 5-maleimide | [no description available] | medium | 1 | 0 | | |
cyclosporine | [no description available] | medium | 41 | 9 | | |
indigo carmine | [no description available] | medium | 4 | 1 | | |
phenazopyridine | [no description available] | medium | 5 | 2 | diaminopyridine; monoazo compound | anticoronaviral agent; carcinogenic agent; local anaesthetic; non-narcotic analgesic |
zineb | [no description available] | medium | 1 | 0 | dithiocarbamate salt; macromolecule; zinc coordination entity | antifungal agrochemical |
maneb | [no description available] | medium | 1 | 0 | | |
nabam | [no description available] | medium | 1 | 0 | dithiocarbamic acids | |
silver | [no description available] | medium | 15 | 0 | copper group element atom; elemental silver | Escherichia coli metabolite |
indocyanine green | [no description available] | medium | 115 | 3 | 1,1-diunsubstituted alkanesulfonate; benzoindole; cyanine dye | |
sodium hydroxide | [no description available] | medium | 5 | 0 | alkali metal hydroxide | |
rhodamine b | [no description available] | medium | 55 | 0 | organic chloride salt; xanthene dye | fluorescent probe; fluorochrome; histological dye |
sulfuric acid | [no description available] | medium | 2 | 0 | sulfur oxoacid | catalyst |
perfluorophenanthrene | [no description available] | medium | 1 | 0 | fluorocarbon | radioopaque medium |
rhodamine 123 | [no description available] | medium | 21 | 0 | organic cation; xanthene dye | fluorochrome |
colistin | [no description available] | medium | 1 | 0 | | |
glycerol | [no description available] | medium | 17 | 0 | alditol; triol | algal metabolite; detergent; Escherichia coli metabolite; geroprotector; human metabolite; mouse metabolite; osmolyte; Saccharomyces cerevisiae metabolite; solvent |
hydrogen sulfide | [no description available] | medium | 11 | 0 | gas molecular entity; hydracid; mononuclear parent hydride; sulfur hydride | Escherichia coli metabolite; genotoxin; metabolite; signalling molecule; toxin; vasodilator agent |
fluorescein-5-isothiocyanate | [no description available] | medium | 135 | 1 | fluorescein isothiocyanate | |
nadp | [no description available] | medium | 5 | 0 | | |
benoxinate | [no description available] | medium | 8 | 2 | amino acid ester; benzoate ester; substituted aniline; tertiary amino compound | drug allergen; local anaesthetic; topical anaesthetic |
procaine | [no description available] | medium | 13 | 2 | benzoate ester; substituted aniline; tertiary amino compound | central nervous system depressant; drug allergen; local anaesthetic; peripheral nervous system drug |
trehalose | [no description available] | medium | 9 | 1 | trehalose | Escherichia coli metabolite; geroprotector; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite |
pilocarpine | [no description available] | medium | 13 | 1 | pilocarpine | antiglaucoma drug |
eosine yellowish-(ys) | [no description available] | medium | 24 | 0 | organic sodium salt; organobromine compound | fluorochrome; histological dye |
gadolinium | [no description available] | medium | 7 | 0 | f-block element atom; lanthanoid atom | |
cobalt | [no description available] | medium | 7 | 0 | cobalt group element atom; metal allergen | micronutrient |
xanthenes | [no description available] | medium | 63 | 0 | xanthene | |
diethyl chlorophosphate | [no description available] | medium | 1 | 0 | | |
mitomycin | [no description available] | medium | 8 | 0 | mitomycin | alkylating agent; antineoplastic agent |
singlet oxygen | [no description available] | medium | 11 | 0 | chalcogen; monoatomic oxygen; nonmetal atom | macronutrient |
carbon monoxide | [no description available] | medium | 4 | 0 | carbon 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 |
picric acid | [no description available] | medium | 3 | 0 | C-nitro compound | antiseptic drug; explosive; fixative |
yttrium | [no description available] | medium | 2 | 0 | d-block element atom; rare earth metal atom; scandium group element atom | |
acrylamide | [no description available] | medium | 3 | 0 | acrylamides; N-acylammonia; primary carboxamide | alkylating agent; carcinogenic agent; Maillard reaction product; mutagen; neurotoxin |
yttria | [no description available] | medium | 1 | 0 | | |
evans blue | [no description available] | medium | 40 | 0 | organic sodium salt | fluorochrome; histological dye; sodium channel blocker; teratogenic agent |
aminolevulinic acid | [no description available] | medium | 18 | 0 | 4-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 |
atropine | [no description available] | medium | 4 | 0 | | |
delphinidin | [no description available] | medium | 5 | 0 | anthocyanidin chloride | |
berberine | [no description available] | medium | 2 | 0 | alkaloid antibiotic; berberine alkaloid; botanical anti-fungal agent; organic heteropentacyclic compound | antilipemic drug; antineoplastic agent; antioxidant; EC 1.1.1.141 [15-hydroxyprostaglandin dehydrogenase (NAD(+))] inhibitor; EC 1.1.1.21 (aldehyde reductase) inhibitor; EC 1.13.11.52 (indoleamine 2,3-dioxygenase) inhibitor; EC 1.21.3.3 (reticuline oxidase) inhibitor; EC 2.1.1.116 [3'-hydroxy-N-methyl-(S)-coclaurine 4'-O-methyltransferase] inhibitor; EC 2.1.1.122 [(S)-tetrahydroprotoberberine N-methyltransferase] inhibitor; EC 2.7.11.10 (IkappaB kinase) inhibitor; EC 3.1.1.4 (phospholipase A2) inhibitor; EC 3.1.1.7 (acetylcholinesterase) inhibitor; EC 3.1.1.8 (cholinesterase) inhibitor; EC 3.1.3.48 (protein-tyrosine-phosphatase) inhibitor; EC 3.4.14.5 (dipeptidyl-peptidase IV) inhibitor; EC 3.4.21.26 (prolyl oligopeptidase) inhibitor; geroprotector; hypoglycemic agent; metabolite; potassium channel blocker |
betadex | [no description available] | medium | 11 | 0 | cyclodextrin | |
peroxynitrous acid | [no description available] | medium | 12 | 0 | nitrogen oxoacid | |
ruthenium | [no description available] | medium | 6 | 0 | iron group element atom; platinum group metal atom | |
calixarenes | [no description available] | medium | 4 | 0 | | |
calix(4)arene | [no description available] | medium | 1 | 0 | | |
gamma-aminobutyric acid | [no description available] | medium | 7 | 0 | amino acid zwitterion; gamma-amino acid; monocarboxylic acid | human metabolite; neurotransmitter; Saccharomyces cerevisiae metabolite; signalling molecule |
glutamic acid | [no description available] | medium | 17 | 0 | glutamic acid; glutamine family amino acid; L-alpha-amino acid; proteinogenic amino acid | Escherichia coli metabolite; ferroptosis inducer; micronutrient; mouse metabolite; neurotransmitter; nutraceutical |
methotrexate | [no description available] | medium | 18 | 0 | dicarboxylic 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 |
betamethasone | [no description available] | medium | 1 | 0 | 11beta-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 |
diquafosol | [no description available] | medium | 16 | 7 | pyrimidine ribonucleoside 5'-tetraphosphate; uridine 5'-phosphate | mouse metabolite; P2Y2 receptor agonist |
warfarin | [no description available] | medium | 39 | 0 | benzenes; hydroxycoumarin; methyl ketone | |
gold | [no description available] | medium | 60 | 0 | copper group element atom; elemental gold | |
scopolamine hydrobromide | [no description available] | medium | 2 | 0 | | |
isothiocyanic acid | [no description available] | medium | 39 | 0 | hydracid; one-carbon compound | |
tetracycline | [no description available] | medium | 4 | 0 | | |
levofloxacin | [no description available] | medium | 1 | 0 | 9-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 |
varenicline | [no description available] | medium | 1 | 1 | | |
cellulose | [no description available] | medium | 19 | 0 | glycoside | |
methamphetamine | [no description available] | medium | 4 | 0 | amphetamines; secondary amine | central nervous system stimulant; environmental contaminant; neurotoxin; psychotropic drug; xenobiotic |
alpha-synuclein | [no description available] | medium | 2 | 0 | | |
hypochlorous acid | [no description available] | medium | 5 | 0 | chlorine oxoacid; reactive oxygen species | EC 2.5.1.18 (glutathione transferase) inhibitor; EC 3.1.1.7 (acetylcholinesterase) inhibitor; human metabolite |
silicon | [no description available] | medium | 20 | 0 | carbon group element atom; metalloid atom; nonmetal atom | |
acridine orange | [no description available] | medium | 13 | 0 | aminoacridines; aromatic amine; tertiary amino compound | fluorochrome; histological dye |
azides | [no description available] | medium | 19 | 0 | pseudohalide anion | mitochondrial respiratory-chain inhibitor |
fluorine | [no description available] | medium | 4 | 0 | diatomic fluorine; gas molecular entity | NMR chemical shift reference compound |
fluorides | [no description available] | medium | 5 | 0 | halide anion; monoatomic fluorine | |
folic acid | [no description available] | medium | 16 | 1 | folic acids; N-acyl-amino acid | human metabolite; mouse metabolite; nutrient |
benzotriazole | [no description available] | medium | 1 | 0 | benzotriazoles | environmental contaminant; xenobiotic |
thiophenes | [no description available] | medium | 11 | 6 | mancude organic heteromonocyclic parent; monocyclic heteroarene; thiophenes; volatile organic compound | non-polar solvent |
cysteine | [no description available] | medium | 42 | 0 | cysteinium | fundamental metabolite |
rivaroxaban | [no description available] | medium | 1 | 0 | aromatic amide; lactam; monocarboxylic acid amide; morpholines; organochlorine compound; oxazolidinone; thiophenes | anticoagulant; EC 3.4.21.6 (coagulation factor Xa) inhibitor |
paraquat | [no description available] | medium | 5 | 0 | organic cation | geroprotector; herbicide |
cyanamide | [no description available] | medium | 2 | 0 | nitrile; one-carbon compound | EC 1.2.1.3 [aldehyde dehydrogenase (NAD(+))] inhibitor |
riboflavin | [no description available] | medium | 14 | 1 | flavin; vitamin B2 | anti-inflammatory agent; antioxidant; cofactor; Escherichia coli metabolite; food colouring; fundamental metabolite; human urinary metabolite; mouse metabolite; photosensitizing agent; plant metabolite |
furosemide | [no description available] | medium | 6 | 1 | chlorobenzoic acid; furans; sulfonamide | environmental contaminant; loop diuretic; xenobiotic |
dodecaborate | [no description available] | medium | 1 | 0 | | |
interleukin-8 | [no description available] | medium | 5 | 0 | | |
hydrazine | [no description available] | medium | 15 | 0 | azane; hydrazines | EC 4.3.1.10 (serine-sulfate ammonia-lyase) inhibitor |
ketoprofen | [no description available] | medium | 4 | 0 | benzophenones; oxo monocarboxylic acid | antipyretic; drug allergen; EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor; environmental contaminant; non-steroidal anti-inflammatory drug; xenobiotic |
naproxen | [no description available] | medium | 1 | 0 | methoxynaphthalene; monocarboxylic acid | antipyretic; cyclooxygenase 1 inhibitor; cyclooxygenase 2 inhibitor; drug allergen; environmental contaminant; gout suppressant; non-narcotic analgesic; non-steroidal anti-inflammatory drug; xenobiotic |
lactoferrin | [no description available] | medium | 2 | 0 | | |
lysophosphatidic acid | [no description available] | medium | 2 | 0 | 1-acyl-sn-glycerol 3-phosphate | |
chitosan | [no description available] | medium | 29 | 0 | | |
erythrosine | [no description available] | medium | 1,475 | 38 | | |
tellurium | [no description available] | medium | 2 | 0 | chalcogen; metalloid atom | |
cadmium telluride | [no description available] | medium | 2 | 0 | | |
opc 12759 | [no description available] | medium | 7 | 2 | secondary carboxamide | |
methylene blue | [no description available] | medium | 24 | 2 | organic chloride salt | acid-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 |
lidocaine | [no description available] | medium | 6 | 1 | benzenes; monocarboxylic acid amide; tertiary amino compound | anti-arrhythmia drug; drug allergen; environmental contaminant; local anaesthetic; xenobiotic |
lysine | [no description available] | medium | 14 | 1 | aspartate 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 |
phenylalanine | [no description available] | medium | 12 | 1 | amino 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 |
tryptophan | [no description available] | medium | 16 | 0 | erythrose 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 |
okadaic acid | [no description available] | medium | 2 | 0 | ketal | |
malondialdehyde | [no description available] | medium | 5 | 0 | dialdehyde | biomarker |
ovalbumin | [no description available] | medium | 14 | 0 | | |
d-alpha tocopherol | [no description available] | medium | 6 | 0 | alpha-tocopherol | algal metabolite; antiatherogenic agent; anticoagulant; antioxidant; antiviral agent; EC 2.7.11.13 (protein kinase C) inhibitor; immunomodulator; micronutrient; nutraceutical; plant metabolite |
tocophersolan | [no description available] | medium | 1 | 0 | tocol | |
benzophenoneidum | [no description available] | medium | 1 | 0 | hydrochloride | fluorochrome; histological dye |
biotin | [no description available] | medium | 102 | 0 | biotins; vitamin B7 | coenzyme; cofactor; Escherichia coli metabolite; fundamental metabolite; human metabolite; mouse metabolite; nutraceutical; prosthetic group; Saccharomyces cerevisiae metabolite |
2-propanol | [no description available] | medium | 21 | 0 | secondary alcohol; secondary fatty alcohol | protic solvent |
2-propanol | [no description available] | medium | 21 | 1 | secondary alcohol; secondary fatty alcohol | protic solvent |
ochratoxin a | [no description available] | medium | 3 | 0 | isochromanes; monocarboxylic acid amide; N-acyl-L-phenylalanine; organochlorine compound; phenylalanine derivative | Aspergillus metabolite; calcium channel blocker; carcinogenic agent; mycotoxin; nephrotoxin; Penicillium metabolite; teratogenic agent |
2,4-dichlorophenoxyacetic acid | [no description available] | medium | 3 | 0 | chlorophenoxyacetic acid; dichlorobenzene | agrochemical; defoliant; EC 1.1.1.25 (shikimate dehydrogenase) inhibitor; environmental contaminant; phenoxy herbicide; synthetic auxin |
tobramycin | [no description available] | medium | 3 | 1 | amino cyclitol glycoside | antibacterial agent; antimicrobial agent; toxin |
arginyl-glycyl-aspartic acid | [no description available] | medium | 5 | 0 | oligopeptide | |
heptanol | [no description available] | medium | 2 | 0 | heptanol; primary alcohol | flavouring agent; fragrance; gap junctional intercellular communication inhibitor; plant metabolite |
vancomycin | [no description available] | medium | 3 | 0 | glycopeptide | antibacterial drug; antimicrobial agent; bacterial metabolite |
methane | [no description available] | medium | 11 | 0 | alkane; gas molecular entity; mononuclear parent hydride; one-carbon compound | bacterial metabolite; fossil fuel; greenhouse gas |
deoxyuridine | [no description available] | medium | 4 | 0 | pyrimidine 2'-deoxyribonucleoside | Escherichia coli metabolite; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite |
pifithrin | [no description available] | medium | 1 | 0 | aromatic ketone | |
curcumin | [no description available] | medium | 5 | 0 | aromatic ether; beta-diketone; diarylheptanoid; enone; polyphenol | anti-inflammatory agent; antifungal agent; antineoplastic agent; biological pigment; contraceptive drug; dye; EC 1.1.1.205 (IMP dehydrogenase) inhibitor; EC 1.1.1.21 (aldehyde reductase) inhibitor; EC 1.1.1.25 (shikimate dehydrogenase) inhibitor; EC 1.6.5.2 [NAD(P)H dehydrogenase (quinone)] inhibitor; EC 1.8.1.9 (thioredoxin reductase) inhibitor; EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor; EC 3.5.1.98 (histone deacetylase) inhibitor; flavouring agent; food colouring; geroprotector; hepatoprotective agent; immunomodulator; iron chelator; ligand; lipoxygenase inhibitor; metabolite; neuroprotective agent; nutraceutical; radical scavenger |
deoxycytidine | [no description available] | medium | 2 | 0 | pyrimidine 2'-deoxyribonucleoside | Escherichia coli metabolite; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite |
diclofenac | [no description available] | medium | 7 | 4 | amino 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 |
ferrous chloride | [no description available] | medium | 1 | 0 | iron coordination entity | |
safranine t | [no description available] | medium | 2 | 0 | organic chloride salt | fluorochrome; histological dye |
nile red | [no description available] | medium | 12 | 0 | aromatic amine; cyclic ketone; organic heterotetracyclic compound; tertiary amino compound | fluorochrome; histological dye |
oligonucleotides | [no description available] | medium | 73 | 0 | | |
coumarin | [no description available] | medium | 21 | 0 | coumarins | fluorescent dye; human metabolite; plant metabolite |
arginine | [no description available] | medium | 33 | 0 | arginine; glutamine family amino acid; L-alpha-amino acid; proteinogenic amino acid | biomarker; Escherichia coli metabolite; micronutrient; mouse metabolite; nutraceutical |
glycyrrhizic acid | [no description available] | medium | 4 | 1 | enone; glucosiduronic acid; pentacyclic triterpenoid; tricarboxylic acid; triterpenoid saponin | EC 3.4.21.5 (thrombin) inhibitor; plant metabolite |
phosphatidylcholines | [no description available] | medium | 28 | 0 | 1,2-diacyl-sn-glycero-3-phosphocholine | |
cerium | [no description available] | medium | 2 | 0 | f-block element atom; lanthanoid atom | |
pyridine | [no description available] | medium | 2 | 0 | azaarene; mancude organic heteromonocyclic parent; monocyclic heteroarene; pyridines | environmental contaminant; NMR chemical shift reference compound |
cocaine | [no description available] | medium | 5 | 0 | benzoate 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 |
orabase | [no description available] | medium | 8 | 2 | | |
sphingosine | [no description available] | medium | 5 | 0 | sphing-4-enine | human metabolite; mouse metabolite |
sphingosine 1-phosphate | [no description available] | medium | 4 | 0 | sphingoid 1-phosphate | mouse metabolite; signalling molecule; sphingosine-1-phosphate receptor agonist; T-cell proliferation inhibitor; vasodilator agent |
rhodamine 6g | [no description available] | medium | 32 | 0 | | |
sepharose | [no description available] | medium | 7 | 0 | | |
ibuprofen | [no description available] | medium | 6 | 0 | monocarboxylic acid | antipyretic; cyclooxygenase 1 inhibitor; cyclooxygenase 2 inhibitor; drug allergen; environmental contaminant; geroprotector; non-narcotic analgesic; non-steroidal anti-inflammatory drug; radical scavenger; xenobiotic |
omega-n-methylarginine | [no description available] | medium | 13 | 0 | amino acid zwitterion; arginine derivative; guanidines; L-arginine derivative; non-proteinogenic L-alpha-amino acid | |
agar | [no description available] | medium | 3 | 0 | | |
caffeine | [no description available] | medium | 4 | 0 | purine 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 |
n-acetylneuraminic acid | [no description available] | medium | 4 | 0 | N-acetylneuraminic acids | antioxidant; bacterial metabolite; EC 3.2.1.18 (exo-alpha-sialidase) inhibitor; human metabolite; mouse metabolite |
erucyl amide | [no description available] | medium | 2 | 0 | 13-docosenamide | EC 3.1.1.7 (acetylcholinesterase) inhibitor; human metabolite; mammalian metabolite; plant metabolite; rat metabolite |
fullerene c60 | [no description available] | medium | 3 | 0 | fullerene | geroprotector |
cyanides | [no description available] | medium | 6 | 0 | pseudohalide anion | EC 1.9.3.1 (cytochrome c oxidase) inhibitor |
carbocyanines | [no description available] | medium | 38 | 0 | cyanine dye; organic iodide salt | fluorochrome |
1-anilino-8-naphthalenesulfonate | [no description available] | medium | 7 | 0 | aminonaphthalene; naphthalenesulfonic acid | fluorescent probe |
digoxigenin | [no description available] | medium | 25 | 0 | 12beta-hydroxy steroid; 14beta-hydroxy steroid; 3beta-hydroxy steroid; 3beta-sterol | hapten; plant metabolite |
transforming growth factor beta | [no description available] | medium | 7 | 0 | | |
dithiothreitol | [no description available] | medium | 7 | 0 | 1,4-dimercaptobutane-2,3-diol; butanediols; dithiol; glycol; thiol | chelator; human metabolite; reducing agent |
sodium dodecyl sulfate | [no description available] | medium | 7 | 0 | organic sodium salt | detergent; protein denaturant |
thiazoles | [no description available] | medium | 12 | 0 | 1,3-thiazoles; mancude organic heteromonocyclic parent; monocyclic heteroarene | |
mirabegron | [no description available] | medium | 1 | 0 | 1,3-thiazoles; aromatic amide; ethanolamines; monocarboxylic acid amide | beta-adrenergic agonist |
osmium | [no description available] | medium | 1 | 0 | iron group element atom; platinum group metal atom | |
dapi | [no description available] | medium | 11 | 0 | indoles | fluorochrome |
acetylcysteine | [no description available] | medium | 2 | 0 | acetylcysteine; 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 |
europium | [no description available] | medium | 8 | 0 | f-block element atom; lanthanoid atom | |
terbium | [no description available] | medium | 7 | 0 | f-block element atom; lanthanoid atom | |
curium | [no description available] | medium | 1 | 0 | actinoid atom; f-block element atom | |
enterobactin | [no description available] | medium | 2 | 0 | catechols; crown compound; macrotriolide; polyphenol | bacterial metabolite; siderophore |
4,4'-bipyridyl | [no description available] | medium | 1 | 0 | bipyridine | |
3,3',5,5'-tetramethylbenzidine | [no description available] | medium | 3 | 0 | | |
uridine triphosphate | [no description available] | medium | 12 | 0 | pyrimidine ribonucleoside 5'-triphosphate; uridine 5'-phosphate | Escherichia coli metabolite; mouse metabolite |
rg108 | [no description available] | medium | 1 | 0 | indolyl carboxylic acid | |
homocysteine | [no description available] | medium | 6 | 0 | amino acid zwitterion; homocysteine; serine family amino acid | fundamental metabolite; mouse metabolite |
sulfites | [no description available] | medium | 2 | 0 | divalent inorganic anion; sulfur oxide; sulfur oxoanion | |
dalteparin | [no description available] | medium | 1 | 0 | | |
cyclic gmp | [no description available] | medium | 17 | 0 | 3',5'-cyclic purine nucleotide; guanyl ribonucleotide | Escherichia coli metabolite; human metabolite; mouse metabolite; plant metabolite; Saccharomyces cerevisiae metabolite |
muramidase | [no description available] | medium | 24 | 0 | | |
(3-mercaptopropyl)trimethoxysilane | [no description available] | medium | 1 | 0 | | |
limestone | [no description available] | medium | 1 | 0 | calcium salt; carbonate salt; inorganic calcium salt; one-carbon compound | antacid; fertilizer; food colouring; food firming agent |
phosphine | [no description available] | medium | 2 | 0 | mononuclear parent hydride; phosphanes; phosphine | carcinogenic agent; fumigant insecticide |
n-methyladenosine | [no description available] | medium | 1 | 0 | methyladenosine | |
adenosine | [no description available] | medium | 13 | 0 | adenosines; purines D-ribonucleoside | analgesic; anti-arrhythmia drug; fundamental metabolite; human metabolite; vasodilator agent |
pyrroles | [no description available] | medium | 5 | 0 | pyrrole; secondary amine | |
sodium sulfide | [no description available] | medium | 2 | 0 | | |
sodium bisulfide | [no description available] | medium | 1 | 0 | | |
tricyclazole | [no description available] | medium | 1 | 0 | triazolobenzothiazole | antifungal agrochemical; melanin synthesis inhibitor |
glucose, (beta-d)-isomer | [no description available] | medium | 5 | 0 | D-glucopyranose | epitope; mouse metabolite |
ascorbic acid | [no description available] | medium | 15 | 0 | ascorbic acid; vitamin C | coenzyme; cofactor; flour treatment agent; food antioxidant; food colour retention agent; geroprotector; plant metabolite; skin lightening agent |
2,3-dioxo-6-nitro-7-sulfamoylbenzo(f)quinoxaline | [no description available] | medium | 2 | 0 | naphthalenes; sulfonic acid derivative | |
quinoxalines | [no description available] | medium | 6 | 2 | mancude organic heterobicyclic parent; naphthyridine; ortho-fused heteroarene | |
thiazolyl blue | [no description available] | medium | 6 | 0 | organic bromide salt | colorimetric reagent; dye |
ammonium sulfate | [no description available] | medium | 1 | 0 | ammonium salt; inorganic sulfate salt | fertilizer |
ammonium peroxydisulfate | [no description available] | medium | 1 | 0 | | |
durapatite | [no description available] | medium | 7 | 1 | | |
n,n,n',n'-tetramethylethylenediamine | [no description available] | medium | 1 | 0 | ethylenediamine derivative | catalyst; chelator |
6-carboxyfluorescein | [no description available] | medium | 28 | 0 | monocarboxylic acid | |
texas red | [no description available] | medium | 25 | 0 | organic heteroheptacyclic compound | fluorochrome |
fluorouracil | [no description available] | medium | 5 | 0 | nucleobase analogue; organofluorine compound | antimetabolite; antineoplastic agent; environmental contaminant; immunosuppressive agent; radiosensitizing agent; xenobiotic |
coenzyme q10 | [no description available] | medium | 1 | 0 | ubiquinones | antioxidant; ferroptosis inhibitor; human metabolite |
ubiquinone | [no description available] | medium | 1 | 0 | | |
dehydroepiandrosterone | [no description available] | medium | 1 | 0 | 17-oxo steroid; 3beta-hydroxy-Delta(5)-steroid; androstanoid | androgen; human metabolite; mouse metabolite |
tropicamide | [no description available] | medium | 5 | 2 | acetamides | |
propoxycaine | [no description available] | medium | 11 | 2 | benzoate ester | |
proxymetacaine | [no description available] | medium | 11 | 2 | benzoate ester | |
phenyl acetate | [no description available] | medium | 6 | 1 | benzenes; phenyl acetates | |
glycine | [no description available] | medium | 6 | 1 | alpha-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 |
aluminum phthalocyanine | [no description available] | medium | 1 | 0 | organic molecular entity | |
phthalocyanine | [no description available] | medium | 2 | 0 | phthalocyanines; tetrapyrrole fundamental parent | |
proflavine | [no description available] | medium | 1 | 0 | aminoacridines | antibacterial agent; antiseptic drug; carcinogenic agent; chromophore; intercalator |
protoporphyrin ix | [no description available] | medium | 6 | 0 | | |
acetic acid | [no description available] | medium | 6 | 0 | monocarboxylic acid | antimicrobial food preservative; Daphnia magna metabolite; food acidity regulator; protic solvent |
iodine | [no description available] | medium | 4 | 0 | halide anion; monoatomic iodine | human metabolite |
zithromax | [no description available] | medium | 3 | 3 | macrolide antibiotic | antibacterial drug; environmental contaminant; xenobiotic |
esculin | [no description available] | medium | 1 | 1 | beta-D-glucoside; hydroxycoumarin | antioxidant; metabolite |
pectins | [no description available] | medium | 2 | 0 | D-galactopyranuronic acid | |
ethyl cellulose | [no description available] | medium | 4 | 0 | glycoside | |
lactic acid | [no description available] | medium | 28 | 0 | 2-hydroxy monocarboxylic acid | algal metabolite; Daphnia magna metabolite |
capsaicin | [no description available] | medium | 5 | 0 | capsaicinoid | non-narcotic analgesic; TRPV1 agonist; voltage-gated sodium channel blocker |
5-aminolevulinic acid hexyl ester | [no description available] | medium | 1 | 0 | organonitrogen compound; organooxygen compound | |
selenocysteine | [no description available] | medium | 2 | 0 | | |
lissamine rhodamine b | [no description available] | medium | 11 | 0 | | |
deoxycholic acid | [no description available] | medium | 5 | 0 | bile acid; C24-steroid; dihydroxy-5beta-cholanic acid | human blood serum metabolite |
1,2-dilauroylphosphatidylcholine | [no description available] | medium | 2 | 0 | 1,2-diacyl-sn-glycero-3-phosphocholine(1+) | |
zinc sulfate | [no description available] | medium | 1 | 0 | metal sulfate; zinc molecular entity | fertilizer |
oregon green 488 carboxylic acid | [no description available] | medium | 8 | 0 | xanthene dye | epitope; fluorochrome |
tetracaine | [no description available] | medium | 3 | 0 | benzoate ester; tertiary amino compound | local anaesthetic |
mercury | [no description available] | medium | 11 | 0 | elemental mercury; zinc group element atom | neurotoxin |
4,5-diaminofluorescein diacetate | [no description available] | medium | 86 | 0 | | |
ferric chloride | [no description available] | medium | 2 | 0 | iron coordination entity | astringent; Lewis acid |
chlorine | [no description available] | medium | 12 | 0 | halide anion; monoatomic chlorine | cofactor; Escherichia coli metabolite; human metabolite |
balafilcon a | [no description available] | medium | 1 | 0 | | |
methylcellulose | [no description available] | medium | 9 | 3 | | |
enkephalin, leucine | [no description available] | medium | 3 | 0 | pentapeptide; peptide zwitterion | analgesic; delta-opioid receptor agonist; human metabolite; mu-opioid receptor agonist; neurotransmitter; rat metabolite |
biphalin | [no description available] | medium | 1 | 0 | | |
maleimide | [no description available] | medium | 5 | 0 | dicarboximide; maleimides | EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor |
enkephalin, d-penicillamine (2,5)- | [no description available] | medium | 1 | 0 | heterodetic cyclic peptide | delta-opioid receptor agonist |
heparitin sulfate | [no description available] | medium | 3 | 0 | | |
bromodeoxyuridine | [no description available] | medium | 5 | 0 | pyrimidine 2'-deoxyribonucleoside | antimetabolite; antineoplastic agent |
stilbenes | [no description available] | medium | 5 | 0 | stilbene | |
mannitol | [no description available] | medium | 18 | 1 | mannitol | allergen; 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 |
cobaltous chloride | [no description available] | medium | 2 | 0 | cobalt salt; inorganic chloride | allergen; calcium channel blocker; sensitiser; two-colour indicator |
hydralazine | [no description available] | medium | 3 | 0 | azaarene; hydrazines; ortho-fused heteroarene; phthalazines | antihypertensive agent; vasodilator agent |
2',7'-bis(carboxyethyl)-5(6)-carboxyfluorescein | [no description available] | medium | 1 | 0 | | |
4,4'-diisothiocyanostilbene-2,2'-disulfonic acid | [no description available] | medium | 4 | 0 | | |
salicylates | [no description available] | medium | 6 | 0 | monohydroxybenzoate | plant metabolite |
gamma-glycidoxypropyltrimethoxysilane | [no description available] | medium | 2 | 0 | | |
bromodeoxyuridine triphosphate | [no description available] | medium | 1 | 0 | | |
triamcinolone acetonide | [no description available] | medium | 6 | 1 | 11beta-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 |
plastoquinone | [no description available] | medium | 3 | 2 | plastoquinone | |
epichlorohydrin | [no description available] | medium | 3 | 0 | epoxide; organochlorine compound | |
arsenic | [no description available] | medium | 10 | 0 | metalloid atom; pnictogen | micronutrient |
2',7'-dichlorofluorescein | [no description available] | medium | 6 | 0 | 2-benzofurans | fluorochrome |
alanine | [no description available] | medium | 8 | 1 | alanine zwitterion; alanine; L-alpha-amino acid; proteinogenic amino acid; pyruvate family amino acid | EC 4.3.1.15 (diaminopropionate ammonia-lyase) inhibitor; fundamental metabolite |
carbostyril | [no description available] | medium | 7 | 1 | monohydroxyquinoline; quinolone | bacterial xenobiotic metabolite |
piperidines | [no description available] | medium | 4 | 0 | | |
tetramethylrhodamine | [no description available] | medium | 41 | 0 | xanthene dye | |
dipicolinic acid | [no description available] | medium | 1 | 0 | pyridinedicarboxylic acid | bacterial metabolite |
tromethamine | [no description available] | medium | 2 | 0 | primary amino compound; triol | buffer |
5-carboxytetramethylrhodamine succinimidyl ester | [no description available] | medium | 12 | 0 | | |
neutral red | [no description available] | medium | 3 | 0 | hydrochloride | acid-base indicator; dye; two-colour indicator |
glycolipids | [no description available] | medium | 3 | 0 | | |
naphthalimides | [no description available] | medium | 2 | 0 | | |
9,10-diphenylanthracene | [no description available] | medium | 1 | 0 | anthracenes | fluorochrome; photosensitizing agent |
phenylacetylene | [no description available] | medium | 1 | 0 | benzenes | |
benzeneboronic acid | [no description available] | medium | 2 | 0 | boronic acids | |
acetylene | [no description available] | medium | 2 | 0 | alkyne; gas molecular entity; terminal acetylenic compound | |
naphthoquinones | [no description available] | medium | 2 | 0 | | |
lycorine | [no description available] | medium | 1 | 0 | indolizidine alkaloid | anticoronaviral agent; antimalarial; plant metabolite; protein synthesis inhibitor |
acrylic acid | [no description available] | medium | 8 | 0 | alpha,beta-unsaturated monocarboxylic acid | metabolite |
1,4,7,10-tetraazacyclododecane- 1,4,7,10-tetraacetic acid | [no description available] | medium | 3 | 0 | azamacrocycle | chelator; copper chelator |
loteprednol etabonate | [no description available] | medium | 2 | 2 | 11beta-hydroxy steroid; 3-oxo-Delta(1),Delta(4)-steroid; etabonate ester; organochlorine compound; steroid acid ester; steroid ester | anti-inflammatory drug |
diphenylamine | [no description available] | medium | 1 | 0 | aromatic amine; bridged diphenyl fungicide; secondary amino compound | antifungal agrochemical; antioxidant; carotogenesis inhibitor; EC 1.3.99.29 [phytoene desaturase (zeta-carotene-forming)] inhibitor; ferroptosis inhibitor; radical scavenger |
robenacoxib | [no description available] | medium | 1 | 0 | aromatic amino acid; monocarboxylic acid; organofluorine compound; phenylacetic acids; secondary amino compound | cyclooxygenase 2 inhibitor; non-narcotic analgesic; non-steroidal anti-inflammatory drug |
lucifer yellow | [no description available] | medium | 15 | 0 | organic lithium salt | fluorochrome |
potassium periodate | [no description available] | medium | 1 | 0 | | |
metaperiodate | [no description available] | medium | 3 | 0 | iodine oxoacid | |
catechol | [no description available] | medium | 1 | 0 | catechols | allelochemical; genotoxin; plant metabolite |
tinopal | [no description available] | medium | 1 | 0 | | |
triethoxysilane | [no description available] | medium | 1 | 0 | | |
mobic | [no description available] | medium | 1 | 0 | 1,3-thiazoles; benzothiazine; monocarboxylic acid amide | analgesic; antirheumatic drug; cyclooxygenase 2 inhibitor; non-steroidal anti-inflammatory drug |
propidium | [no description available] | medium | 9 | 0 | phenanthridines; quaternary ammonium ion | fluorochrome; intercalator |
deuterium oxide | [no description available] | medium | 2 | 0 | deuterated compound; water | NMR solvent |
choline | [no description available] | medium | 2 | 0 | cholines | allergen; Daphnia magna metabolite; Escherichia coli metabolite; human metabolite; mouse metabolite; neurotransmitter; nutrient; plant metabolite; Saccharomyces cerevisiae metabolite |
sinapine | [no description available] | medium | 1 | 0 | acylcholine | antioxidant; photosynthetic electron-transport chain inhibitor; plant metabolite |
xenon | [no description available] | medium | 4 | 0 | monoatomic xenon; noble gas atom; p-block element atom | |
thiourea | [no description available] | medium | 6 | 0 | one-carbon compound; thioureas; ureas | antioxidant; chromophore |
fipronil | [no description available] | medium | 1 | 0 | (trifluoromethyl)benzenes; dichlorobenzene; nitrile; primary amino compound; pyrazoles; sulfoxide | |
aflatoxin b1 | [no description available] | medium | 4 | 0 | aflatoxin; aromatic ether; aromatic ketone | carcinogenic agent; human metabolite |
furaldehyde | [no description available] | medium | 1 | 0 | aldehyde; furans | Maillard reaction product; metabolite |
5-hydroxymethylfurfural | [no description available] | medium | 1 | 0 | arenecarbaldehyde; furans; primary alcohol | indicator; Maillard reaction product |
quinine | [no description available] | medium | 3 | 0 | cinchona alkaloid | antimalarial; muscle relaxant; non-narcotic analgesic |
resveratrol | [no description available] | medium | 4 | 0 | resveratrol | antioxidant; phytoalexin; plant metabolite; quorum sensing inhibitor; radical scavenger |
quercetin | [no description available] | medium | 4 | 0 | 7-hydroxyflavonol; pentahydroxyflavone | antibacterial agent; antineoplastic agent; antioxidant; Aurora kinase inhibitor; chelator; EC 1.10.99.2 [ribosyldihydronicotinamide dehydrogenase (quinone)] inhibitor; geroprotector; phytoestrogen; plant metabolite; protein kinase inhibitor; radical scavenger |
inosine | [no description available] | medium | 2 | 0 | inosines; purines D-ribonucleoside | Escherichia coli metabolite; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite |
concanavalin a | [no description available] | medium | 12 | 0 | | |
sulforhodamine 101 | [no description available] | medium | 5 | 0 | organic heteroheptacyclic compound | fluorochrome |
cellulase | [no description available] | medium | 3 | 0 | cellotriose | |
lignin | [no description available] | medium | 2 | 0 | | |
prednisolone | [no description available] | medium | 5 | 1 | 11beta-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 |
prednisolone acetate | [no description available] | medium | 1 | 0 | corticosteroid hormone | |
morphine | [no description available] | medium | 5 | 0 | morphinane alkaloid; organic heteropentacyclic compound; tertiary amino compound | anaesthetic; drug allergen; environmental contaminant; geroprotector; mu-opioid receptor agonist; opioid analgesic; plant metabolite; vasodilator agent; xenobiotic |
chondroitin sulfates | [no description available] | medium | 6 | 0 | | |
substance p | [no description available] | medium | 11 | 0 | peptide | neurokinin-1 receptor agonist; neurotransmitter; vasodilator agent |
sq-23377 | [no description available] | medium | 2 | 0 | cyclic ether; enol; polyunsaturated fatty acid; very long-chain fatty acid | calcium ionophore; metabolite |
dermatan sulfate | [no description available] | medium | 3 | 0 | amino disaccharide; glycosylgalactose derivative; iduronic acids; oligosaccharide sulfate | |
ebselen | [no description available] | medium | 2 | 0 | benzoselenazole | anti-inflammatory drug; antibacterial agent; anticoronaviral agent; antifungal agent; antineoplastic agent; antioxidant; apoptosis inducer; EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor; EC 1.13.11.34 (arachidonate 5-lipoxygenase) inhibitor; EC 1.3.1.8 [acyl-CoA dehydrogenase (NADP(+))] inhibitor; EC 1.8.1.12 (trypanothione-disulfide reductase) inhibitor; EC 2.5.1.7 (UDP-N-acetylglucosamine 1-carboxyvinyltransferase) inhibitor; EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor; EC 3.1.3.25 (inositol-phosphate phosphatase) inhibitor; EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor; EC 3.5.4.1 (cytosine deaminase) inhibitor; EC 5.1.3.2 (UDP-glucose 4-epimerase) inhibitor; enzyme mimic; ferroptosis inhibitor; genotoxin; hepatoprotective agent; neuroprotective agent; radical scavenger |
trimethyloxamine | [no description available] | medium | 1 | 0 | tertiary amine oxide | Escherichia coli metabolite; metabolite; osmolyte |
1,1-diphenyl-2-picrylhydrazyl | [no description available] | medium | 3 | 0 | | |
fluorexon | [no description available] | medium | 13 | 0 | xanthene dye | fluorochrome |
fluorexon | [no description available] | medium | 13 | 1 | xanthene dye | fluorochrome |
deferoxamine | [no description available] | medium | 4 | 0 | acyclic desferrioxamine | bacterial metabolite; ferroptosis inhibitor; iron chelator; siderophore |
9-(dicyanovinyl)julolidine | [no description available] | medium | 1 | 0 | | |
n-hydroxysuccinimide | [no description available] | medium | 3 | 0 | | |
ophiobolin a | [no description available] | medium | 1 | 0 | cyclic ketone; enal; oxaspiro compound; sesterterpenoid; tertiary alcohol | |
urea | [no description available] | medium | 6 | 0 | isourea; monocarboxylic acid amide; one-carbon compound | Daphnia magna metabolite; Escherichia coli metabolite; fertilizer; flour treatment agent; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite |
glucosamine | [no description available] | medium | 1 | 0 | D-glucosamine | Escherichia coli metabolite; geroprotector; mouse metabolite |
nile blue | [no description available] | medium | 2 | 0 | | |
latanoprost | [no description available] | medium | 7 | 2 | isopropyl ester; prostaglandins Falpha; triol | antiglaucoma drug; antihypertensive agent; EC 4.2.1.1 (carbonic anhydrase) inhibitor; prodrug |
tetramethylrhodamine isothiocyanate | [no description available] | medium | 7 | 0 | | |
n-(4-(7-(diethylamino)-4-methylcoumarin-3-yl))maleimide | [no description available] | medium | 2 | 0 | | |
benzothiazoline | [no description available] | medium | 1 | 0 | | |
4,4-difluoro-4-bora-3a,4a-diaza-s-indacene | [no description available] | medium | 16 | 0 | BODIPY compound | |
metazachlor | [no description available] | medium | 1 | 0 | aromatic amide; organochlorine compound; pyrazoles | environmental contaminant; herbicide; xenobiotic |
oxalic acid | [no description available] | medium | 4 | 0 | alpha,omega-dicarboxylic acid | algal metabolite; human metabolite; plant metabolite |
bromide | [no description available] | medium | 5 | 0 | halide anion; monoatomic bromine | |
ozone | [no description available] | medium | 2 | 0 | elemental molecule; gas molecular entity; reactive oxygen species; triatomic oxygen | antiseptic drug; disinfectant; electrophilic reagent; greenhouse gas; mutagen; oxidising agent; tracer |
formaldehyde | [no description available] | medium | 10 | 0 | aldehyde; one-carbon compound | allergen; carcinogenic agent; disinfectant; EC 3.5.1.4 (amidase) inhibitor; environmental contaminant; Escherichia coli metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite |
platinum | [no description available] | medium | 4 | 0 | elemental platinum; nickel group element atom; platinum group metal atom | |
dinoprostone | [no description available] | medium | 8 | 0 | prostaglandins E | human metabolite; mouse metabolite; oxytocic |
pyrogallol | [no description available] | medium | 1 | 0 | benzenetriol; phenolic donor | plant metabolite |
6-hydroxy-2,5,7,8-tetramethylchroman-2-carboxylic acid | [no description available] | medium | 10 | 0 | chromanol; monocarboxylic acid; phenols | antioxidant; ferroptosis inhibitor; neuroprotective agent; radical scavenger; Wnt signalling inhibitor |
pyrogallol sulfonphthalein | [no description available] | medium | 1 | 0 | | |
isoborneol | [no description available] | medium | 1 | 0 | borneol | |
oxazoles | [no description available] | medium | 2 | 0 | 1,3-oxazoles; mancude organic heteromonocyclic parent; monocyclic heteroarene | |
guanosine triphosphate | [no description available] | medium | 4 | 0 | guanosine 5'-phosphate; purine ribonucleoside 5'-triphosphate | Escherichia coli metabolite; mouse metabolite; uncoupling protein inhibitor |
bourgeonal | [no description available] | medium | 1 | 0 | | |
paclitaxel | [no description available] | medium | 9 | 0 | taxane diterpenoid; tetracyclic diterpenoid | antineoplastic agent; human metabolite; metabolite; microtubule-stabilising agent |
quinone methide | [no description available] | medium | 1 | 0 | quinomethane | |
metformin | [no description available] | medium | 1 | 0 | guanidines | environmental contaminant; geroprotector; hypoglycemic agent; xenobiotic |
n-methylaspartate | [no description available] | medium | 6 | 0 | amino dicarboxylic acid; D-alpha-amino acid; D-aspartic acid derivative; secondary amino compound | neurotransmitter agent |
ifenprodil | [no description available] | medium | 1 | 0 | piperidines | |
ambroxol | [no description available] | medium | 1 | 1 | aromatic amine | |
propyl gallate | [no description available] | medium | 2 | 0 | trihydroxybenzoic acid | |
rhodamine 110 | [no description available] | medium | 7 | 0 | | |
fibrin | [no description available] | medium | 5 | 0 | peptide | |
glucuronic acid | [no description available] | medium | 7 | 0 | D-glucuronic acid | algal metabolite |
luminol | [no description available] | medium | 9 | 0 | | |
proline | [no description available] | medium | 4 | 1 | amino 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 |
leucine | [no description available] | medium | 3 | 1 | amino 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 |
1-monooleoyl-rac-glycerol | [no description available] | medium | 2 | 0 | 1-acylglycerol 18:1; monooleoylglycerol | plant metabolite |
erythrosine | [no description available] | medium | 16 | 0 | | |
pyronine | [no description available] | medium | 2 | 0 | iminium salt; organic chloride salt | histological dye |
rhinacanthin-c | [no description available] | medium | 1 | 0 | | |
camptothecin | [no description available] | medium | 2 | 0 | delta-lactone; pyranoindolizinoquinoline; quinoline alkaloid; tertiary alcohol | antineoplastic agent; EC 5.99.1.2 (DNA topoisomerase) inhibitor; genotoxin; plant metabolite |
rifampin | [no description available] | medium | 1 | 0 | cyclic 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 |
torsemide | [no description available] | medium | 1 | 0 | aminopyridine; N-sulfonylurea; secondary amino compound | antihypertensive agent; loop diuretic |
transferrin | [no description available] | medium | 16 | 0 | | |
hepes | [no description available] | medium | 2 | 0 | HEPES; organosulfonic acid | |
lithium | [no description available] | medium | 4 | 0 | alkali metal atom | |
3,3'-dioctadecylindocarbocyanine | [no description available] | medium | 3 | 0 | Cy5 dye; indolium ion | fluorochrome |
octaarginine | [no description available] | medium | 3 | 0 | | |
glycosides | [no description available] | medium | 1 | 0 | | |
afimoxifene | [no description available] | medium | 3 | 0 | phenols; tertiary amino compound | antineoplastic agent; estrogen receptor antagonist; metabolite |
tamoxifen | [no description available] | medium | 3 | 0 | stilbenoid; 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 |
gamma-linolenic acid | [no description available] | medium | 6 | 4 | linolenic acid; omega-6 fatty acid | human metabolite; mouse metabolite; plant metabolite |
sybr green i | [no description available] | medium | 6 | 0 | benzothiazolium ion; cyanine dye; quinolines; tertiary amine | fluorescent dye |
resazurin | [no description available] | medium | 6 | 0 | phenoxazine | |
1-bromohexadecane | [no description available] | medium | 1 | 0 | | |
2-(dimethylamino)ethyl methacrylate | [no description available] | medium | 1 | 0 | | |
1-bromohexane | [no description available] | medium | 1 | 0 | | |
1-bromopropane | [no description available] | medium | 1 | 0 | bromoalkane; bromohydrocarbon | neurotoxin; solvent |
dimethylaminododecyl methacrylate | [no description available] | medium | 1 | 0 | | |
xanthene-9-carboxylic acid | [no description available] | medium | 1 | 0 | xanthenes | |
apaflurane | [no description available] | medium | 1 | 0 | | |
y 27632 | [no description available] | medium | 2 | 0 | aromatic amide | |
mci 9038 | [no description available] | medium | 1 | 0 | peptide | |
trichloroacetic acid | [no description available] | medium | 3 | 0 | monocarboxylic acid; organochlorine compound | carcinogenic agent; metabolite; mouse metabolite |
anthracene | [no description available] | medium | 4 | 0 | acene; anthracenes; ortho-fused tricyclic hydrocarbon | |
benzoic acid | [no description available] | medium | 5 | 0 | benzoic acids | algal 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 |
amyloid beta-peptides | [no description available] | medium | 2 | 0 | | |
acriflavine | [no description available] | medium | 6 | 0 | | |
cyclopentolate | [no description available] | medium | 1 | 0 | carboxylic ester; tertiary alcohol; tertiary amino compound | diagnostic agent; muscarinic antagonist; mydriatic agent; parasympatholytic |
glyburide | [no description available] | medium | 3 | 0 | monochlorobenzenes; 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 |
dorzolamide | [no description available] | medium | 9 | 6 | sulfonamide; thiophenes | antiglaucoma drug; antihypertensive agent; EC 4.2.1.1 (carbonic anhydrase) inhibitor |
timolol | [no description available] | medium | 10 | 3 | timolol | anti-arrhythmia drug; antiglaucoma drug; antihypertensive agent; beta-adrenergic antagonist |
triethylene glycol dimethacrylate | [no description available] | medium | 2 | 0 | | |
cefotaxime | [no description available] | medium | 2 | 0 | 1,3-thiazoles; cephalosporin; oxime O-ether | antibacterial drug; drug allergen |
sar 1118 | [no description available] | medium | 1 | 1 | 1-benzofurans; isoquinolines; L-phenylalanine derivative; N-acyl-L-alpha-amino acid; sulfone | anti-inflammatory drug; lymphocyte function-associated antigen-1 antagonist |
cryptophane a | [no description available] | medium | 1 | 0 | | |
dexamethasone 21-phosphate | [no description available] | medium | 1 | 0 | 11beta-hydroxy steroid; 17-hydroxy steroid; 3-oxo-Delta(4) steroid; fluorinated steroid; steroid phosphate; tertiary alpha-hydroxy ketone | glucocorticoid receptor agonist |
ethyldimethylaminopropyl carbodiimide | [no description available] | medium | 2 | 0 | | |
phosphoric acid | [no description available] | medium | 3 | 0 | phosphoric acids | algal metabolite; fertilizer; human metabolite; NMR chemical shift reference compound; solvent |
kainic acid | [no description available] | medium | 1 | 0 | dicarboxylic acid; L-proline derivative; non-proteinogenic L-alpha-amino acid; pyrrolidinecarboxylic acid | antinematodal drug; excitatory amino acid agonist |
natriuretic peptide, c-type | [no description available] | medium | 1 | 0 | | |
phenolsulfonphthalein | [no description available] | medium | 11 | 1 | 2,1-benzoxathiole; arenesulfonate ester; phenols; sultone | acid-base indicator; diagnostic agent; two-colour indicator |
elastin | [no description available] | medium | 4 | 0 | oligopeptide | |
hydrochloric acid | [no description available] | medium | 4 | 0 | chlorine molecular entity; gas molecular entity; hydrogen halide; mononuclear parent hydride | mouse metabolite |
prisma-fil | [no description available] | medium | 1 | 0 | | |
thrombin aptamer | [no description available] | medium | 1 | 0 | | |
kanamycin a | [no description available] | medium | 1 | 0 | kanamycins | bacterial metabolite |
octadecyl palmitate | [no description available] | medium | 2 | 1 | hexadecanoate ester; wax ester | coral metabolite; cosmetic |
povidone-iodine | [no description available] | medium | 5 | 1 | | |
nicotine | [no description available] | medium | 6 | 0 | 3-(1-methylpyrrolidin-2-yl)pyridine | anxiolytic drug; biomarker; immunomodulator; mitogen; neurotoxin; nicotinic acetylcholine receptor agonist; peripheral nervous system drug; phytogenic insecticide; plant metabolite; psychotropic drug; teratogenic agent; xenobiotic |
sulfosuccinimidyl-2-(biotinamido)ethyl-1,3-dithiopropionate | [no description available] | medium | 1 | 0 | | |
triclosan | [no description available] | medium | 1 | 1 | aromatic 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 |
acetone | [no description available] | medium | 3 | 0 | ketone body; methyl ketone; propanones; volatile organic compound | EC 3.5.1.4 (amidase) inhibitor; human metabolite; polar aprotic solvent |
fenton's reagent | [no description available] | medium | 3 | 0 | | |
pyruvaldehyde | [no description available] | medium | 4 | 0 | 2-oxo aldehyde; propanals | Escherichia coli metabolite; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite |
4,5-diaminofluorescein | [no description available] | medium | 85 | 1 | | |
perfluorodecalin | [no description available] | medium | 1 | 0 | fluorocarbon | blood substitute; solvent |
1,2-oleoylphosphatidylcholine | [no description available] | medium | 4 | 0 | phosphatidylcholine(1+) | |
qx-314 | [no description available] | medium | 1 | 0 | monocarboxylic acid amide | local anaesthetic |
titanium | [no description available] | medium | 4 | 0 | titanium group element atom | |
wortmannin | [no description available] | medium | 4 | 0 | acetate ester; cyclic ketone; delta-lactone; organic heteropentacyclic compound | anticoronaviral agent; antineoplastic agent; autophagy inhibitor; EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor; geroprotector; Penicillium metabolite; radiosensitizing agent |
mk 2206 | [no description available] | medium | 1 | 0 | organic heterotricyclic compound | EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor |
caprylates | [no description available] | medium | 2 | 0 | fatty acid anion 8:0; straight-chain saturated fatty acid anion | human metabolite; Saccharomyces cerevisiae metabolite |
oleic acid | [no description available] | medium | 3 | 0 | octadec-9-enoic acid | antioxidant; Daphnia galeata metabolite; EC 3.1.1.1 (carboxylesterase) inhibitor; Escherichia coli metabolite; mouse metabolite; plant metabolite; solvent |
dipalmitoylphosphatidic acid | [no description available] | medium | 1 | 0 | phosphatidic acid | |
1,2-dipalmitoylphosphatidylcholine | [no description available] | medium | 4 | 0 | | |
deoxyguanosine triphosphate | [no description available] | medium | 1 | 0 | deoxyguanosine phosphate; guanyl deoxyribonucleotide; purine 2'-deoxyribonucleoside 5'-triphosphate | Arabidopsis thaliana metabolite; Escherichia coli metabolite; human metabolite; mouse metabolite; plant metabolite; Saccharomyces cerevisiae metabolite |
isosorbide dinitrate | [no description available] | medium | 1 | 0 | glucitol derivative; nitrate ester | nitric oxide donor; vasodilator agent |
isosorbide-5-mononitrate | [no description available] | medium | 1 | 0 | glucitol derivative; nitrate ester | nitric oxide donor; vasodilator agent |
mocetinostat | [no description available] | medium | 8 | 0 | aminopyrimidine; benzamides; pyridines; secondary amino compound; secondary carboxamide; substituted aniline | antineoplastic agent; apoptosis inducer; autophagy inducer; cardioprotective agent; EC 3.5.1.98 (histone deacetylase) inhibitor; hepatotoxic agent |
n-vinyl-2-pyrrolidinone | [no description available] | medium | 8 | 2 | pyrrolidin-2-ones | |
methanol | [no description available] | medium | 11 | 0 | alkyl alcohol; one-carbon compound; primary alcohol; volatile organic compound | amphiprotic solvent; Escherichia coli metabolite; fuel; human metabolite; mouse metabolite; Mycoplasma genitalium metabolite |
ethidium | [no description available] | medium | 23 | 0 | phenanthridines | fluorochrome; intercalator |
hydroxide ion | [no description available] | medium | 3 | 0 | oxygen hydride | mouse metabolite |
calcium phosphate, dibasic, dihydrate | [no description available] | medium | 1 | 0 | calcium salt; hydrate | |
tricalcium phosphate | [no description available] | medium | 5 | 0 | calcium phosphate | |
salicylaldehyde | [no description available] | medium | 1 | 0 | hydroxybenzaldehyde | nematicide; plant metabolite |
ferulic acid | [no description available] | medium | 3 | 0 | ferulic acids | anti-inflammatory agent; antioxidant; apoptosis inhibitor; cardioprotective agent; MALDI matrix material; plant metabolite |
didodecyldimethylammonium | [no description available] | medium | 1 | 0 | | |
citrulline | [no description available] | medium | 2 | 0 | amino 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 |
toluene 2,4-diisocyanate | [no description available] | medium | 1 | 0 | toluene meta-diisocyanate | allergen; hapten |
2-hydroxyethyl acrylate | [no description available] | medium | 1 | 0 | | |
cytidine monophosphate | [no description available] | medium | 2 | 0 | cytidine 5'-phosphate; pyrimidine ribonucleoside 5'-monophosphate | Escherichia coli metabolite; human metabolite; mouse metabolite |
hydrogen | [no description available] | medium | 6 | 0 | elemental hydrogen; elemental molecule; gas molecular entity | antioxidant; electron donor; food packaging gas; fuel; human metabolite |
sodium iodide | [no description available] | medium | 2 | 0 | inorganic sodium salt; iodide salt | |
1,1'-diethyl-2,2'-cyanine | [no description available] | medium | 1 | 0 | 1,1'-diethyl-2,2'-cyanine; quinolines | |
thyronines | [no description available] | medium | 1 | 0 | thyronine | |
imidazole | [no description available] | medium | 3 | 0 | imidazole | |
2-naphthol | [no description available] | medium | 4 | 0 | naphthol | antinematodal drug; genotoxin; human urinary metabolite; human xenobiotic metabolite; mouse metabolite; radical scavenger |
procyanidin | [no description available] | medium | 1 | 0 | proanthocyanidin | |
palladium | [no description available] | medium | 4 | 0 | metal allergen; nickel group element atom; platinum group metal atom | |
thioctic acid | [no description available] | medium | 1 | 0 | dithiolanes; heterocyclic fatty acid; thia fatty acid | fundamental metabolite; geroprotector |
vitamin b 12 | [no description available] | medium | 7 | 0 | | |
colchicine | [no description available] | medium | 3 | 0 | alkaloid; colchicine | anti-inflammatory agent; gout suppressant; mutagen |
catechin | [no description available] | medium | 5 | 0 | catechin | antioxidant; plant metabolite |
gallic acid | [no description available] | medium | 3 | 0 | trihydroxybenzoic acid | antineoplastic agent; antioxidant; apoptosis inducer; astringent; cyclooxygenase 2 inhibitor; EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor; geroprotector; human xenobiotic metabolite; plant metabolite |
alkenes | [no description available] | medium | 3 | 0 | | |
thiacalix(4)arene | [no description available] | medium | 1 | 0 | | |
3-nitrotyrosine | [no description available] | medium | 1 | 0 | 2-nitrophenols; C-nitro compound; nitrotyrosine; non-proteinogenic alpha-amino acid | |
tyrosine | [no description available] | medium | 14 | 0 | amino 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 |
pyrene | [no description available] | medium | 7 | 0 | ortho- and peri-fused polycyclic arene | fluorescent probe; persistent organic pollutant |
zoledronic acid | [no description available] | medium | 1 | 0 | 1,1-bis(phosphonic acid); imidazoles | bone density conservation agent |
taurocholic acid | [no description available] | medium | 4 | 0 | amino sulfonic acid; bile acid taurine conjugate | human metabolite |
7-aminocoumarin | [no description available] | medium | 1 | 0 | | |
toluene | [no description available] | medium | 2 | 0 | methylbenzene; toluenes; volatile organic compound | cholinergic antagonist; fuel additive; neurotoxin; non-polar solvent |
bafilomycin a1 | [no description available] | medium | 1 | 0 | cyclic hemiketal; macrolide antibiotic; oxanes | apoptosis inducer; autophagy inhibitor; bacterial metabolite; EC 3.6.3.10 (H(+)/K(+)-exchanging ATPase) inhibitor; EC 3.6.3.14 (H(+)-transporting two-sector ATPase) inhibitor; ferroptosis inhibitor; fungicide; potassium ionophore; toxin |
simvastatin | [no description available] | medium | 2 | 0 | delta-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 |
lovastatin | [no description available] | medium | 1 | 0 | delta-lactone; fatty acid ester; hexahydronaphthalenes; polyketide; statin (naturally occurring) | anticholesteremic drug; antineoplastic agent; Aspergillus metabolite; prodrug |
omeprazole | [no description available] | medium | 1 | 0 | aromatic ether; benzimidazoles; pyridines; sulfoxide | |
heme | [no description available] | medium | 2 | 0 | | |
thiocyanate | [no description available] | medium | 2 | 0 | pseudohalide anion; sulfur molecular entity | human metabolite |
l-lysine methyl ester | [no description available] | medium | 1 | 0 | L-lysyl ester | |
gliotoxin | [no description available] | medium | 1 | 0 | dipeptide; organic disulfide; organic heterotetracyclic compound; pyrazinoindole | antifungal agent; EC 2.5.1.58 (protein farnesyltransferase) inhibitor; immunosuppressive agent; mycotoxin; proteasome inhibitor |
dihydrotestosterone | [no description available] | medium | 1 | 0 | 17beta-hydroxy steroid; 17beta-hydroxyandrostan-3-one; 3-oxo-5alpha-steroid | androgen; Daphnia magna metabolite; human metabolite; mouse metabolite |
naphthofluorescein | [no description available] | medium | 1 | 0 | xanthenes | |
4-dimethylaminopyridine | [no description available] | medium | 1 | 0 | dialkylarylamine; tertiary amino compound | |
4-aminopyridine | [no description available] | medium | 2 | 0 | aminopyridine; aromatic amine | avicide; orphan drug; potassium channel blocker |
azetidine | [no description available] | medium | 1 | 0 | azacycloalkane; azetidines; saturated organic heteromonocyclic parent | |
hexachlorocyclotriphosphazene | [no description available] | medium | 1 | 0 | | |
n-acetylhistidine | [no description available] | medium | 1 | 0 | L-histidine derivative; N-acetyl-L-amino acid; N-acetylhistidine | animal metabolite |
4-hydroxyphenylacetic acid | [no description available] | medium | 1 | 0 | monocarboxylic acid; phenols | fungal metabolite; human metabolite; mouse metabolite; plant metabolite |
histidine | [no description available] | medium | 11 | 0 | amino 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 |
imidazoleacetic acid | [no description available] | medium | 1 | 0 | imidazoles; monocarboxylic acid | metabolite; mouse metabolite |
1-methyl-3-ethylimidazolium | [no description available] | medium | 1 | 0 | 1-alkyl-3-methylimidazolium | |
fluorosulfonic acid | [no description available] | medium | 1 | 0 | sulfur oxoacid | NMR solvent |
fluorometholone | [no description available] | medium | 4 | 2 | 11beta-hydroxy steroid; 17alpha-hydroxy steroid; 20-oxo steroid; 3-oxo-Delta(1),Delta(4)-steroid; fluorinated steroid; glucocorticoid; tertiary alpha-hydroxy ketone | anti-inflammatory drug |
gemcitabine | [no description available] | medium | 1 | 0 | organofluorine 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 |
thymosin beta(4) | [no description available] | medium | 1 | 1 | | |
thymosin | [no description available] | medium | 1 | 1 | | |
gentian violet | [no description available] | medium | 8 | 0 | organic chloride salt | anthelminthic drug; antibacterial agent; antifungal agent; antiseptic drug; histological dye |
thiosemicarbazide | [no description available] | medium | 2 | 0 | hydrazines; thiocarboxamide; thioureas | |
metaperiodate | [no description available] | medium | 2 | 0 | iodine oxoanion; monovalent inorganic anion | |
bpc 157 | [no description available] | medium | 1 | 0 | | |
2-aminopurine | [no description available] | medium | 2 | 0 | 2-aminopurines; nucleobase analogue | antimetabolite |
laponite | [no description available] | medium | 2 | 0 | | |
lead | [no description available] | medium | 2 | 0 | carbon group element atom; elemental lead; metal atom | neurotoxin |
sanguinarine | [no description available] | medium | 1 | 0 | alkaloid antibiotic; benzophenanthridine alkaloid; botanical anti-fungal agent | |
chelerythrine | [no description available] | medium | 1 | 0 | benzophenanthridine alkaloid; organic cation | antibacterial agent; antineoplastic agent; EC 2.7.11.13 (protein kinase C) inhibitor |
cascade blue | [no description available] | medium | 1 | 0 | aminonaphthalene | fluorochrome |
amiloride | [no description available] | medium | 6 | 0 | aromatic amine; guanidines; organochlorine compound; pyrazines | diuretic; sodium channel blocker |
atorvastatin | [no description available] | medium | 1 | 0 | aromatic amide; dihydroxy monocarboxylic acid; monofluorobenzenes; pyrroles; statin (synthetic) | environmental contaminant; xenobiotic |
thioridazine | [no description available] | medium | 1 | 0 | phenothiazines; 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 |
n-isopropylacrylamide | [no description available] | medium | 1 | 0 | | |
citric acid, anhydrous | [no description available] | medium | 2 | 0 | tricarboxylic acid | antimicrobial agent; chelator; food acidity regulator; fundamental metabolite |
ajoene | [no description available] | medium | 1 | 0 | sulfoxide | |
sarcosine | [no description available] | medium | 2 | 0 | N-alkylglycine zwitterion; N-alkylglycine; N-methyl-amino acid; N-methylglycines | Escherichia coli metabolite; glycine receptor agonist; glycine transporter 1 inhibitor; human metabolite; mouse metabolite |
efinaconazole | [no description available] | medium | 1 | 1 | conazole antifungal drug; olefinic compound; organofluorine compound; piperidines; tertiary alcohol; tertiary amino compound; triazole antifungal drug | EC 1.14.13.70 (sterol 14alpha-demethylase) inhibitor |
triazoles | [no description available] | medium | 9 | 2 | 1,2,3-triazole | |
pulmicort | [no description available] | medium | 3 | 0 | 11beta-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 |
budesonide, formoterol fumarate drug combination | [no description available] | medium | 1 | 0 | | |
pyridoxine | [no description available] | medium | 2 | 0 | hydroxymethylpyridine; methylpyridines; monohydroxypyridine; vitamin B6 | cofactor; Escherichia coli metabolite; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite |
retinol | [no description available] | medium | 2 | 0 | retinol; vitamin A | human metabolite; mouse metabolite; plant metabolite |
retinol palmitate | [no description available] | medium | 2 | 0 | all-trans-retinyl ester; retinyl palmitate | antioxidant; Escherichia coli metabolite; human xenobiotic metabolite |
glyoxal | [no description available] | medium | 1 | 0 | dialdehyde | agrochemical; allergen; pesticide; plant growth regulator |
guanidine | [no description available] | medium | 1 | 0 | carboxamidine; guanidines; one-carbon compound | |
adenosine monophosphate | [no description available] | medium | 5 | 0 | adenosine 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 |
guanosine monophosphate | [no description available] | medium | 1 | 0 | guanosine 5'-phosphate; purine ribonucleoside 5'-monophosphate | biomarker; Escherichia coli metabolite; metabolite; mouse metabolite |
tyramine | [no description available] | medium | 8 | 0 | monoamine molecular messenger; primary amino compound; tyramines | EC 3.1.1.8 (cholinesterase) inhibitor; Escherichia coli metabolite; human metabolite; mouse metabolite; neurotransmitter |
chromium | [no description available] | medium | 3 | 0 | chromium group element atom; metal allergen | micronutrient |
glycerylphosphorylcholine | [no description available] | medium | 1 | 0 | glycerophosphocholine | |
sodium borohydride | [no description available] | medium | 1 | 0 | inorganic sodium salt; metal tetrahydridoborate | |
melamine | [no description available] | medium | 2 | 0 | triamino-1,3,5-triazine | xenobiotic metabolite |
cimetidine | [no description available] | medium | 5 | 0 | aliphatic sulfide; guanidines; imidazoles; nitrile | adjuvant; analgesic; anti-ulcer drug; H2-receptor antagonist; P450 inhibitor |
valproic acid | [no description available] | medium | 5 | 0 | branched-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 |
benzoylphenylalanine | [no description available] | medium | 1 | 0 | 2-(benzoylamino)-3-phenylpropanoic acid; N-acyl-L-phenylalanine | |
cytochrome c-t | [no description available] | medium | 6 | 0 | | |
dimethylsulfonioacetate | [no description available] | medium | 1 | 0 | sulfonium betaine | |
betaine | [no description available] | medium | 2 | 0 | amino-acid betaine; glycine derivative | fundamental metabolite |
n-methylolacrylamide | [no description available] | medium | 1 | 0 | secondary carboxamide | |
holmium | [no description available] | medium | 1 | 0 | f-block element atom; lanthanoid atom | |
epidermal growth factor | [no description available] | medium | 3 | 0 | | |
framycetin | [no description available] | medium | 3 | 0 | aminoglycoside | allergen; antibacterial drug; Escherichia coli metabolite |
firefly luciferin | [no description available] | medium | 3 | 0 | 1,3-thiazolemonocarboxylic acid; benzothiazoles; imidothioate | luciferin |
2-cyanobenzothiazole | [no description available] | medium | 1 | 0 | | |
limonene | [no description available] | medium | 4 | 0 | cycloalkene; p-menthadiene | human metabolite |
3-mercaptopropionic acid | [no description available] | medium | 1 | 0 | mercaptopropanoic acid | algal metabolite |
cysteamine | [no description available] | medium | 3 | 0 | amine; thiol | geroprotector; human metabolite; mouse metabolite; radiation protective agent |
baicalein | [no description available] | medium | 1 | 0 | trihydroxyflavone | angiogenesis inhibitor; anti-inflammatory agent; antibacterial agent; anticoronaviral agent; antifungal agent; antineoplastic agent; antioxidant; apoptosis inducer; EC 1.13.11.31 (arachidonate 12-lipoxygenase) inhibitor; EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor; EC 3.4.21.26 (prolyl oligopeptidase) inhibitor; EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor; EC 4.1.1.17 (ornithine decarboxylase) inhibitor; ferroptosis inhibitor; geroprotector; hormone antagonist; plant metabolite; prostaglandin antagonist; radical scavenger |
baicalin | [no description available] | medium | 1 | 0 | dihydroxyflavone; glucosiduronic acid; glycosyloxyflavone; monosaccharide derivative | antiatherosclerotic agent; antibacterial agent; anticoronaviral agent; antineoplastic agent; antioxidant; cardioprotective agent; EC 2.7.7.48 (RNA-directed RNA polymerase) inhibitor; EC 3.4.21.26 (prolyl oligopeptidase) inhibitor; ferroptosis inhibitor; neuroprotective agent; non-steroidal anti-inflammatory drug; plant metabolite; prodrug |
verapamil | [no description available] | medium | 6 | 0 | aromatic ether; nitrile; polyether; tertiary amino compound | |
nitroxyl | [no description available] | medium | 1 | 0 | nitrogen oxoacid | |
mebeverine | [no description available] | medium | 1 | 0 | | |
3-hydroxybutyric acid | [no description available] | medium | 1 | 1 | (omega-1)-hydroxy fatty acid; 3-hydroxy monocarboxylic acid; hydroxybutyric acid | human metabolite |
caseins | [no description available] | medium | 6 | 0 | | |
iodoacetamide | [no description available] | medium | 4 | 0 | | |
cadaverine | [no description available] | medium | 6 | 0 | alkane-alpha,omega-diamine | Daphnia magna metabolite; Escherichia coli metabolite; mouse metabolite; plant metabolite |
phencyclidine | [no description available] | medium | 4 | 0 | benzenes; piperidines | anaesthetic; neurotoxin; NMDA receptor antagonist; psychotropic drug |
mesalamine | [no description available] | medium | 1 | 0 | amino acid; aromatic amine; monocarboxylic acid; monohydroxybenzoic acid; phenols | non-steroidal anti-inflammatory drug |
azathioprine | [no description available] | medium | 2 | 0 | aryl sulfide; C-nitro compound; imidazoles; thiopurine | antimetabolite; antineoplastic agent; carcinogenic agent; DNA synthesis inhibitor; hepatotoxic agent; immunosuppressive agent; prodrug |
neurokinin b | [no description available] | medium | 1 | 0 | polypeptide | |
dihydroethidium | [no description available] | medium | 4 | 0 | | |
benzofurans | [no description available] | medium | 1 | 0 | | |
gw9508 | [no description available] | medium | 1 | 0 | aromatic amine | |
flag peptide | [no description available] | medium | 1 | 0 | peptide | |
tak-875 | [no description available] | medium | 1 | 0 | biphenyls | |
terbinafine | [no description available] | medium | 1 | 0 | acetylenic compound; allylamine antifungal drug; enyne; naphthalenes; tertiary amine | EC 1.14.13.132 (squalene monooxygenase) inhibitor; P450 inhibitor; sterol biosynthesis inhibitor |
adenosine-5'-(n-ethylcarboxamide) | [no description available] | medium | 3 | 0 | adenosines; monocarboxylic acid amide | adenosine A1 receptor agonist; adenosine A2A receptor agonist; antineoplastic agent; EC 3.1.4.* (phosphoric diester hydrolase) inhibitor; vasodilator agent |
daptomycin | [no description available] | medium | 1 | 0 | | |
formazans | [no description available] | medium | 2 | 0 | | |
tyrosinamide | [no description available] | medium | 1 | 0 | amino acid amide; L-tyrosine derivative | |
corticosterone | [no description available] | medium | 1 | 0 | 11beta-hydroxy steroid; 20-oxo steroid; 21-hydroxy steroid; 3-oxo-Delta(4) steroid; C21-steroid; glucocorticoid; primary alpha-hydroxy ketone | human metabolite; mouse metabolite |
methylamine | [no description available] | medium | 2 | 0 | methylamines; one-carbon compound; primary aliphatic amine | mouse metabolite |
cobrotoxin | [no description available] | medium | 1 | 0 | | |
neurotoxin ii, naja naja oxiana | [no description available] | medium | 1 | 0 | | |
brilliant green | [no description available] | medium | 1 | 0 | organic hydrogensulfate salt | antibacterial agent; antiseptic drug; environmental contaminant; fluorochrome; histological dye; poison |
palmitic acid | [no description available] | medium | 1 | 0 | long-chain fatty acid; straight-chain saturated fatty acid | algal metabolite; Daphnia magna metabolite; EC 1.1.1.189 (prostaglandin-E2 9-reductase) inhibitor; plant metabolite |
nickel | [no description available] | medium | 4 | 0 | metal allergen; nickel group element atom | epitope; micronutrient |
metronidazole | [no description available] | medium | 1 | 0 | C-nitro compound; imidazoles; primary alcohol | antiamoebic agent; antibacterial drug; antimicrobial agent; antiparasitic agent; antitrichomonal drug; environmental contaminant; prodrug; radiosensitizing agent; xenobiotic |
hydroxyl radical | [no description available] | medium | 6 | 0 | oxygen hydride; oxygen radical; reactive oxygen species | |
tretinoin | [no description available] | medium | 6 | 0 | retinoic 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 |
imiquimod | [no description available] | medium | 1 | 0 | imidazoquinoline | antineoplastic agent; interferon inducer |
technetium | [no description available] | medium | 3 | 0 | manganese group element atom | |
ro13-9904 | [no description available] | medium | 1 | 0 | | |
trimethoxyvinylsilane | [no description available] | medium | 1 | 0 | | |
tribromoethanol | [no description available] | medium | 1 | 0 | alcohol; organobromine compound | |
xylazine | [no description available] | medium | 1 | 0 | 1,3-thiazine; methylbenzene; secondary amino compound | alpha-adrenergic agonist; analgesic; emetic; muscle relaxant; sedative |
ketamine | [no description available] | medium | 1 | 0 | cyclohexanones; monochlorobenzenes; secondary amino compound | analgesic; environmental contaminant; intravenous anaesthetic; neurotoxin; NMDA receptor antagonist; xenobiotic |
butyltriphenylphosphonium | [no description available] | medium | 1 | 0 | | |
sulfur | [no description available] | medium | 2 | 0 | chalcogen; nonmetal atom | macronutrient |
nitrobenzene | [no description available] | medium | 1 | 0 | nitroarene; nitrobenzenes | |
cytarabine | [no description available] | medium | 2 | 0 | beta-D-arabinoside; monosaccharide derivative; pyrimidine nucleoside | antimetabolite; antineoplastic agent; antiviral agent; immunosuppressive agent |
kp372-1 | [no description available] | medium | 1 | 0 | | |
maltodextrin | [no description available] | medium | 1 | 0 | | |
pyrethrins | [no description available] | medium | 2 | 0 | | |
cyfluthrin | [no description available] | medium | 1 | 0 | aromatic ether; cyclopropanecarboxylate ester; nitrile; organochlorine compound; organofluorine compound | agrochemical; pyrethroid ester insecticide |
cephalosporin c | [no description available] | medium | 5 | 0 | cephalosporin | fungal metabolite |
p-dimethylaminoazobenzene | [no description available] | medium | 8 | 0 | azobenzenes | |
4-(4-dimethylaminophenylazo)benzoic acid | [no description available] | medium | 8 | 0 | | |
c.i. 42510 | [no description available] | medium | 11 | 0 | | |
iso-sulfan blue | [no description available] | medium | 5 | 0 | | |
kresoxim-methyl | [no description available] | medium | 1 | 0 | aromatic ether; methoxyiminoacetate strobilurin antifungal agent; methyl ester; oxime O-ether | antifungal agrochemical; environmental contaminant; mitochondrial cytochrome-bc1 complex inhibitor; xenobiotic |
trifloxystrobin | [no description available] | medium | 1 | 0 | | |
picoxystrobin | [no description available] | medium | 1 | 0 | aromatic ether; enoate ester; enol ether; methoxyacrylate strobilurin antifungal agent; organofluorine compound; pyridines | antifungal agrochemical; mitochondrial cytochrome-bc1 complex inhibitor |
furan | [no description available] | medium | 1 | 0 | furans; mancude organic heteromonocyclic parent; monocyclic heteroarene | carcinogenic agent; hepatotoxic agent; Maillard reaction product |
salen | [no description available] | medium | 1 | 0 | | |
salophen | [no description available] | medium | 1 | 0 | | |
cresyl violet | [no description available] | medium | 1 | 0 | | |
fasudil | [no description available] | medium | 1 | 0 | isoquinolines; 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 |
1-(5-isoquinolinesulfonyl)-2-methylpiperazine | [no description available] | medium | 3 | 0 | isoquinolines; N-sulfonylpiperazine | EC 2.7.11.13 (protein kinase C) inhibitor |
sucrose | [no description available] | medium | 10 | 0 | glycosyl glycoside | algal metabolite; Escherichia coli metabolite; human metabolite; mouse metabolite; osmolyte; Saccharomyces cerevisiae metabolite; sweetening agent |
1,2-diaminoanthraquinone | [no description available] | medium | 1 | 0 | | |
5-dimethylaminonaphthalene-1-sulfonamide | [no description available] | medium | 1 | 0 | | |
ethylene glycol | [no description available] | medium | 5 | 1 | ethanediol; glycol | metabolite; mouse metabolite; solvent; toxin |
2-aminoisobutyric acid | [no description available] | medium | 1 | 0 | 2,2-dialkylglycine zwitterion; 2,2-dialkylglycine | |
emerimicins | [no description available] | medium | 1 | 0 | | |
adenosine diphosphate | [no description available] | medium | 12 | 0 | adenosine 5'-phosphate; purine ribonucleoside 5'-diphosphate | fundamental metabolite; human metabolite |
docetaxel anhydrous | [no description available] | medium | 2 | 0 | secondary alpha-hydroxy ketone; tetracyclic diterpenoid | antimalarial; antineoplastic agent; photosensitizing agent |
cholesteryl succinate | [no description available] | medium | 1 | 0 | cholestane ester; dicarboxylic acid monoester; hemisuccinate | detergent |
indomethacin | [no description available] | medium | 18 | 1 | aromatic 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 |
1,2-dioleoyloxy-3-(trimethylammonium)propane | [no description available] | medium | 4 | 0 | | |
resorcinarene | [no description available] | medium | 1 | 0 | | |
almagate | [no description available] | medium | 1 | 0 | | |
helium | [no description available] | medium | 2 | 0 | monoatomic helium; noble gas atom; s-block element atom | food packaging gas |
ng-nitroarginine methyl ester | [no description available] | medium | 27 | 0 | alpha-amino acid ester; L-arginine derivative; methyl ester; N-nitro compound | EC 1.14.13.39 (nitric oxide synthase) inhibitor |
7-nitroindazole | [no description available] | medium | 2 | 0 | | |
indazoles | [no description available] | medium | 4 | 1 | indazole | |
meso-chlorin e(6) monoethylene diamine | [no description available] | medium | 1 | 0 | | |
n-(2-hydroxypropyl)methacrylamide | [no description available] | medium | 1 | 0 | | |
benzene | [no description available] | medium | 3 | 0 | aromatic annulene; benzenes; volatile organic compound | carcinogenic agent; environmental contaminant; non-polar solvent |
resorufin | [no description available] | medium | 4 | 0 | phenoxazine | |
flash-edt2 | [no description available] | medium | 1 | 0 | | |
naringenin | [no description available] | medium | 1 | 0 | (2S)-flavan-4-one; naringenin | expectorant; plant metabolite |
phalloidine | [no description available] | medium | 5 | 0 | homodetic cyclic peptide | |
tricaine | [no description available] | medium | 1 | 0 | methanesulfonate salt | general anaesthetic |
diphenylhexatriene | [no description available] | medium | 2 | 0 | alkatriene | fluorochrome |
etodolac | [no description available] | medium | 2 | 0 | monocarboxylic acid; organic heterotricyclic compound | antipyretic; cyclooxygenase 2 inhibitor; non-narcotic analgesic; non-steroidal anti-inflammatory drug |
(hexadecanoyl)aminofluorescein | [no description available] | medium | 3 | 0 | | |
1-(4'-carboxyethyl)-6-diphenyl-1,3,5-hexatriene | [no description available] | medium | 1 | 0 | | |
vanadates | [no description available] | medium | 2 | 0 | trivalent inorganic anion; vanadium oxoanion | EC 3.1.3.1 (alkaline phosphatase) inhibitor; EC 3.1.3.16 (phosphoprotein phosphatase) inhibitor; EC 3.1.3.41 (4-nitrophenylphosphatase) inhibitor; EC 3.1.3.48 (protein-tyrosine-phosphatase) inhibitor |
chlorhexidine | [no description available] | medium | 3 | 1 | biguanides; monochlorobenzenes | antibacterial agent; antiinfective agent |
phenylthiourea | [no description available] | medium | 1 | 0 | thioureas | EC 1.14.18.1 (tyrosinase) inhibitor |
thymidine | [no description available] | medium | 5 | 0 | pyrimidine 2'-deoxyribonucleoside | Escherichia coli metabolite; human metabolite; metabolite; mouse metabolite |
benzamidine | [no description available] | medium | 1 | 0 | benzenes; carboxamidine | serine protease inhibitor |
ergonovine | [no description available] | medium | 1 | 0 | ergot alkaloid; monocarboxylic acid amide; organic heterotetracyclic compound; primary alcohol; secondary amino compound; tertiary amino compound | diagnostic agent; fungal metabolite; oxytocic; toxin |
dicumarol | [no description available] | medium | 1 | 0 | hydroxycoumarin | anticoagulant; EC 1.6.5.2 [NAD(P)H dehydrogenase (quinone)] inhibitor; Hsp90 inhibitor; vitamin K antagonist |
aniline | [no description available] | medium | 2 | 0 | anilines; primary arylamine | |
phenolphthalein | [no description available] | medium | 3 | 0 | phenols | |
galactose | [no description available] | medium | 6 | 0 | D-galactose; galactopyranose | Escherichia coli metabolite; mouse metabolite |
hirudin | [no description available] | medium | 3 | 0 | | |
niobium | [no description available] | medium | 1 | 0 | vanadium group element atom | |
sulfur hexafluoride | [no description available] | medium | 4 | 0 | sulfur coordination entity | greenhouse gas; NMR chemical shift reference compound; ultrasound contrast agent |
coomassie brilliant blue | [no description available] | medium | 2 | 0 | | |
gadolinium dtpa | [no description available] | medium | 6 | 0 | gadolinium coordination entity | MRI contrast agent |
taxane | [no description available] | medium | 1 | 0 | diterpene; terpenoid fundamental parent | |
cephalomannine | [no description available] | medium | 1 | 0 | | |
eosine i bluish | [no description available] | medium | 8 | 0 | organic sodium salt | fluorescent dye; histological dye |
ciprofloxacin | [no description available] | medium | 3 | 1 | aminoquinoline; 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 |
sodium fluoride | [no description available] | medium | 5 | 3 | fluoride salt | mutagen |
guanine | [no description available] | medium | 5 | 0 | 2-aminopurines; oxopurine; purine nucleobase | algal metabolite; Escherichia coli metabolite; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite |
8-hydroxyguanine | [no description available] | medium | 1 | 0 | oxopurine | |
sodium nitrate | [no description available] | medium | 1 | 0 | inorganic nitrate salt; inorganic sodium salt | fertilizer; NMR chemical shift reference compound |
alitretinoin | [no description available] | medium | 1 | 0 | retinoic acid | antineoplastic agent; keratolytic drug; metabolite; retinoid X receptor agonist |
nitrates | [no description available] | medium | 8 | 1 | monovalent inorganic anion; nitrogen oxoanion; reactive nitrogen species | |
cyanine dye 3 | [no description available] | medium | 18 | 0 | | |
aspartic acid | [no description available] | medium | 5 | 0 | aspartate family amino acid; aspartic acid; L-alpha-amino acid; proteinogenic amino acid | Escherichia coli metabolite; mouse metabolite; neurotransmitter |
3-(2-furoyl)quinoline-2-carbaldehyde | [no description available] | medium | 2 | 0 | | |
phenylephrine | [no description available] | medium | 5 | 0 | phenols; phenylethanolamines; secondary amino compound | alpha-adrenergic agonist; cardiotonic drug; mydriatic agent; nasal decongestant; protective agent; sympathomimetic agent; vasoconstrictor agent |
potassium nitrate | [no description available] | medium | 1 | 1 | inorganic nitrate salt; potassium salt | fertilizer |
theophylline | [no description available] | medium | 8 | 0 | dimethylxanthine | adenosine 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 |
s-(2,4-dinitrophenyl)glutathione | [no description available] | medium | 1 | 0 | glutathione conjugate | |
zinc oxide | [no description available] | medium | 3 | 0 | zinc molecular entity | |
all-bond 2 | [no description available] | medium | 1 | 0 | | |
zearalenone | [no description available] | medium | 1 | 0 | macrolide; resorcinols | fungal metabolite; mycoestrogen |
oxytetracycline, anhydrous | [no description available] | medium | 1 | 0 | | |
nitroarginine | [no description available] | medium | 4 | 0 | guanidines; L-arginine derivative; N-nitro compound; non-proteinogenic L-alpha-amino acid | |
prednisolone hemisuccinate | [no description available] | medium | 1 | 0 | 11beta-hydroxy steroid; 17alpha-hydroxy steroid; 20-oxo steroid; 3-oxo-Delta(1),Delta(4)-steroid; hemisuccinate; tertiary alpha-hydroxy ketone | anti-inflammatory drug |
erythromycin | [no description available] | medium | 1 | 0 | cyclic ketone; erythromycin | |
quinidine | [no description available] | medium | 1 | 0 | cinchona alkaloid | alpha-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 |
hydrogen carbonate | [no description available] | medium | 6 | 1 | carbon oxoanion | cofactor; Escherichia coli metabolite; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite |
pentylenetetrazole | [no description available] | medium | 1 | 0 | organic heterobicyclic compound; organonitrogen heterocyclic compound | |
piracetam | [no description available] | medium | 2 | 0 | organonitrogen compound; organooxygen compound | |
levetiracetam | [no description available] | medium | 2 | 0 | pyrrolidin-2-ones | anticonvulsant; environmental contaminant; xenobiotic |
s-nitrosoglutathione | [no description available] | medium | 2 | 0 | glutathione derivative; nitrosothio compound | bronchodilator agent; nitric oxide donor; platelet aggregation inhibitor; signalling molecule |
uric acid | [no description available] | medium | 2 | 0 | uric acid | Escherichia coli metabolite; human metabolite; mouse metabolite |
s-nitrosocysteinylglycine | [no description available] | medium | 1 | 0 | dipeptide; nitroso compound; nitrosothio compound | |
1-palmitoyl-2-oleoylphosphatidylcholine | [no description available] | medium | 4 | 0 | | |
dodecyltrimethylammonium | [no description available] | medium | 1 | 0 | quaternary ammonium ion | |
bisindolylmaleimide iii | [no description available] | medium | 1 | 0 | indoles; maleimides | EC 2.7.11.13 (protein kinase C) inhibitor |
staurosporine | [no description available] | medium | 3 | 0 | ammonium ion derivative | |
azobenzene | [no description available] | medium | 1 | 0 | azobenzenes | |
nitrites | [no description available] | medium | 9 | 0 | monovalent inorganic anion; nitrogen oxoanion; reactive nitrogen species | human metabolite |
pyrophosphate | [no description available] | medium | 1 | 0 | diphosphate ion | |
edetic acid | [no description available] | medium | 15 | 0 | ethylenediamine derivative; polyamino carboxylic acid; tetracarboxylic acid | anticoagulant; antidote; chelator; copper chelator; geroprotector |
5-(n-dodecanoyl)aminofluorescein | [no description available] | medium | 4 | 0 | | |
propranolol | [no description available] | medium | 4 | 0 | naphthalenes; propanolamine; secondary amine | anti-arrhythmia drug; antihypertensive agent; anxiolytic drug; beta-adrenergic antagonist; environmental contaminant; human blood serum metabolite; vasodilator agent; xenobiotic |
genistein | [no description available] | medium | 1 | 0 | 7-hydroxyisoflavones | antineoplastic agent; EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor; geroprotector; human urinary metabolite; phytoestrogen; plant metabolite; tyrosine kinase inhibitor |
phytoestrogens | [no description available] | medium | 1 | 0 | | |
molybdenum | [no description available] | medium | 1 | 0 | chromium group element atom | micronutrient |
1,2-dihydroxybenzene-3,5-disulfonic acid disodium salt | [no description available] | medium | 2 | 0 | organic molecular entity | |
molybdate ion | [no description available] | medium | 1 | 0 | divalent inorganic anion; molybdenum oxoanion | Escherichia coli metabolite |
triphenylphosphine | [no description available] | medium | 1 | 0 | benzenes; tertiary phosphine | NMR chemical shift reference compound; reducing agent |
colforsin | [no description available] | medium | 5 | 0 | acetate ester; cyclic ketone; labdane diterpenoid; organic heterotricyclic compound; tertiary alpha-hydroxy ketone; triol | adenylate cyclase agonist; anti-HIV agent; antihypertensive agent; plant metabolite; platelet aggregation inhibitor; protein kinase A agonist |
egtazic acid | [no description available] | medium | 6 | 0 | diether; tertiary amino compound; tetracarboxylic acid | chelator |
kinetensin | [no description available] | medium | 1 | 0 | oligopeptide | histamine releasing agent; human metabolite |
saccharin | [no description available] | medium | 1 | 1 | 1,2-benzisothiazole; N-sulfonylcarboxamide | environmental contaminant; sweetening agent; xenobiotic |
titanium dioxide | [no description available] | medium | 2 | 0 | titanium oxides | food colouring |
nifedipine | [no description available] | medium | 2 | 1 | C-nitro compound; dihydropyridine; methyl ester | calcium channel blocker; human metabolite; tocolytic agent; vasodilator agent |
dimethyl sulfoxide | [no description available] | medium | 8 | 0 | sulfoxide; volatile organic compound | alkylating agent; antidote; Escherichia coli metabolite; geroprotector; MRI contrast agent; non-narcotic analgesic; polar aprotic solvent; radical scavenger |
sulfonyl chloride | [no description available] | medium | 1 | 0 | sulfuryl halide | |
n-methylpyrrole | [no description available] | medium | 1 | 0 | pyrroles | |
1-methylimidazole | [no description available] | medium | 1 | 0 | imidazoles | |
silicon nitride | [no description available] | medium | 2 | 0 | | |
combretastatin | [no description available] | medium | 1 | 0 | | |
alizarin | [no description available] | medium | 1 | 0 | dihydroxyanthraquinone | chromophore; dye; plant metabolite |
iloprost | [no description available] | medium | 3 | 0 | carbobicyclic compound; monocarboxylic acid; secondary alcohol | platelet aggregation inhibitor; vasodilator agent |
u 62840 | [no description available] | medium | 1 | 0 | carbotricyclic compound; carboxylic acid | antihypertensive agent; cardiovascular drug; human blood serum metabolite; platelet aggregation inhibitor; vasodilator agent; vitamin K antagonist |
n-methylpyrrolidone | [no description available] | medium | 2 | 0 | lactam; N-alkylpyrrolidine; pyrrolidin-2-ones | polar aprotic solvent |
aluminum oxide | [no description available] | medium | 4 | 0 | | |
1-propyl-2-methyl-3-hydroxypyrid-4-one | [no description available] | medium | 1 | 0 | | |
hydroxyethylcellulose | [no description available] | medium | 4 | 0 | | |
acid green 50 | [no description available] | medium | 9 | 2 | | |
5-aminofluorescein | [no description available] | medium | 1 | 0 | primary amino compound | |
1,2-diphytanoylphosphatidylcholine | [no description available] | medium | 1 | 0 | | |
copper sulfate | [no description available] | medium | 2 | 0 | metal sulfate | emetic; fertilizer; sensitiser |
protectin d1 | [no description available] | medium | 1 | 0 | dihydroxydocosahexaenoic acid; protectin; secondary allylic alcohol | anti-inflammatory agent; apoptosis inhibitor; hepatoprotective agent; human xenobiotic metabolite; neuroprotective agent; PPARgamma agonist; specialised pro-resolving mediator |
cyclofenil | [no description available] | medium | 1 | 0 | organic molecular entity | |
ethinyl estradiol | [no description available] | medium | 1 | 0 | 17-hydroxy steroid; 3-hydroxy steroid; terminal acetylenic compound | xenoestrogen |
octane | [no description available] | medium | 1 | 0 | alkane | xenobiotic |
cetyltrimethylammonium ion | [no description available] | medium | 6 | 0 | quaternary ammonium ion | |
docusate | [no description available] | medium | 1 | 0 | diester; organosulfonic acid | |
n-pentanol | [no description available] | medium | 1 | 0 | pentanol; short-chain primary fatty alcohol | human metabolite; plant metabolite |
vantocil | [no description available] | medium | 3 | 2 | | |
biguanides | [no description available] | medium | 4 | 2 | guanidines | |
neostigmine | [no description available] | medium | 2 | 0 | quaternary ammonium ion | antidote to curare poisoning; EC 3.1.1.7 (acetylcholinesterase) inhibitor |
physostigmine | [no description available] | medium | 2 | 0 | carbamate ester; indole alkaloid | antidote to curare poisoning; EC 3.1.1.8 (cholinesterase) inhibitor; miotic |
2,3-naphthalenedicarboxaldehyde | [no description available] | medium | 1 | 0 | | |
sodium cyanide | [no description available] | medium | 1 | 0 | cyanide salt; one-carbon compound; sodium salt | EC 1.15.1.1 (superoxide dismutase) inhibitor |
aspirin | [no description available] | medium | 5 | 1 | benzoic 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 |
vitamin k semiquinone radical | [no description available] | medium | 1 | 0 | | |
aluminum | [no description available] | medium | 3 | 0 | boron group element atom; elemental aluminium; metal atom | |
ag 1879 | [no description available] | medium | 1 | 0 | aromatic amine; monochlorobenzenes; pyrazolopyrimidine | beta-adrenergic antagonist; EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor; geroprotector |
as 1411 | [no description available] | medium | 1 | 0 | | |
spermine | [no description available] | medium | 6 | 0 | polyazaalkane; tetramine | antioxidant; fundamental metabolite; immunosuppressive agent |
ofloxacin | [no description available] | medium | 1 | 0 | 3-oxo monocarboxylic acid; N-arylpiperazine; N-methylpiperazine; organofluorine compound; oxazinoquinoline | |
selenium | [no description available] | medium | 4 | 0 | chalcogen; nonmetal atom | micronutrient |
nitrogen trioxide | [no description available] | medium | 1 | 0 | nitrogen oxide | |
trypan blue | [no description available] | medium | 19 | 1 | | |
acid phosphatase | [no description available] | medium | 1 | 0 | | |
sulfaphenazole | [no description available] | medium | 1 | 0 | primary 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 |
lanthanum | [no description available] | medium | 3 | 0 | f-block element atom; lanthanoid atom; scandium group element atom | |
strontium | [no description available] | medium | 1 | 0 | alkaline earth metal atom | |
dronabinol | [no description available] | medium | 2 | 1 | benzochromene; diterpenoid; phytocannabinoid; polyketide | cannabinoid receptor agonist; epitope; hallucinogen; metabolite; non-narcotic analgesic |
cytosine | [no description available] | medium | 4 | 0 | aminopyrimidine; pyrimidine nucleobase; pyrimidone | Escherichia coli metabolite; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite |
quinoline | [no description available] | medium | 1 | 0 | azaarene; mancude organic heterobicyclic parent; ortho-fused heteroarene; quinolines | |
ammonium hydroxide | [no description available] | medium | 1 | 0 | inorganic hydroxy compound | food acidity regulator |
hyaluronoglucosaminidase | [no description available] | medium | 9 | 0 | | |
mannose | [no description available] | medium | 7 | 0 | D-aldohexose; D-mannose; mannopyranose | metabolite |
fluorene | [no description available] | medium | 1 | 0 | ortho-fused polycyclic arene; ortho-fused tricyclic hydrocarbon | |
salicylic acid | [no description available] | medium | 7 | 0 | monohydroxybenzoic acid | algal metabolite; antifungal agent; antiinfective agent; EC 1.11.1.11 (L-ascorbate peroxidase) inhibitor; keratolytic drug; plant hormone; plant metabolite |
salicylic acid | [no description available] | medium | 7 | 1 | monohydroxybenzoic acid | algal metabolite; antifungal agent; antiinfective agent; EC 1.11.1.11 (L-ascorbate peroxidase) inhibitor; keratolytic drug; plant hormone; plant metabolite |
leucogentian violet | [no description available] | medium | 2 | 0 | benzenoid aromatic compound | |
thyroxine | [no description available] | medium | 7 | 0 | 2-halophenol; iodophenol; L-phenylalanine derivative; non-proteinogenic L-alpha-amino acid; thyroxine zwitterion; thyroxine | antithyroid drug; human metabolite; mouse metabolite; thyroid hormone |
fluorodeoxyglucose f18 | [no description available] | medium | 2 | 0 | 2-deoxy-2-((18)F)fluoro-D-glucose; 2-deoxy-2-fluoro-aldehydo-D-glucose | |
maraviroc | [no description available] | medium | 1 | 0 | tropane alkaloid | |
vicriviroc | [no description available] | medium | 1 | 0 | (trifluoromethyl)benzenes | |
niacinamide | [no description available] | medium | 3 | 0 | pyridine 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 |
aminophylline | [no description available] | medium | 1 | 0 | mixture | bronchodilator agent; cardiotonic drug |
aluminum chloride | [no description available] | medium | 1 | 0 | aluminium coordination entity | Lewis acid |
prednisone | [no description available] | medium | 1 | 0 | 11-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 |
miltefosine | [no description available] | medium | 1 | 0 | phosphocholines; phospholipid | anti-inflammatory agent; anticoronaviral agent; antifungal agent; antineoplastic agent; antiprotozoal drug; apoptosis inducer; immunomodulator; protein kinase inhibitor |
phosphorylcholine | [no description available] | medium | 2 | 0 | phosphocholines | allergen; epitope; hapten; human metabolite; mouse metabolite |
antimony potassium tartrate | [no description available] | medium | 1 | 0 | | |
1,3-dihydroxy-4,4,5,5-tetramethyl-2-(4-carboxyphenyl)tetrahydroimidazole | [no description available] | medium | 6 | 0 | benzoic acid; imidazolines; organic radical | apoptosis inhibitor; radical scavenger |
technetium tc 99m exametazime | [no description available] | medium | 1 | 0 | | |
carboxypolymethylene | [no description available] | medium | 1 | 0 | | |
propylene glycol | [no description available] | medium | 1 | 0 | glycol; propane-1,2-diols | allergen; human xenobiotic metabolite; mouse metabolite; protic solvent |
roussin's red salt | [no description available] | medium | 1 | 0 | | |
propylene | [no description available] | medium | 1 | 0 | alkene; gas molecular entity | refrigerant; xenobiotic |
myristamidopropyl dimethylamine | [no description available] | medium | 1 | 1 | | |
gadolinium 1,4,7,10-tetraazacyclododecane-n,n',n'',n'''-tetraacetate | [no description available] | medium | 1 | 0 | | |
tacrolimus | [no description available] | medium | 2 | 0 | macrolide lactam | bacterial metabolite; immunosuppressive agent |
decanoic acid | [no description available] | medium | 2 | 0 | medium-chain fatty acid; straight-chain saturated fatty acid | algal metabolite; anti-inflammatory agent; antibacterial agent; human metabolite; plant metabolite; volatile oil component |
propionic acid | [no description available] | medium | 2 | 0 | saturated fatty acid; short-chain fatty acid | antifungal drug |
1,2-dipalmitoyl-3-phosphatidylethanolamine | [no description available] | medium | 5 | 0 | | |
6-cyano-7-nitroquinoxaline-2,3-dione | [no description available] | medium | 1 | 0 | quinoxaline derivative | |
clofibric acid | [no description available] | medium | 1 | 0 | aromatic ether; monocarboxylic acid; monochlorobenzenes | anticholesteremic drug; antilipemic drug; antineoplastic agent; herbicide; marine xenobiotic metabolite; PPARalpha agonist |
adamantane | [no description available] | medium | 2 | 0 | adamantanes; polycyclic alkane | |
sphingosine kinase | [no description available] | medium | 3 | 0 | | |
stearylamine | [no description available] | medium | 1 | 0 | primary aliphatic amine | film-forming compound |
oseltamivir | [no description available] | medium | 1 | 0 | acetamides; amino acid ester; cyclohexenecarboxylate ester; primary amino compound | antiviral drug; EC 3.2.1.18 (exo-alpha-sialidase) inhibitor; environmental contaminant; prodrug; xenobiotic |
iridium | [no description available] | medium | 1 | 0 | cobalt group element atom; platinum group metal atom | |
13,19-didesmethyl spirolide c | [no description available] | medium | 1 | 0 | | |
hexadecanethiol | [no description available] | medium | 1 | 0 | | |
dimercaprol | [no description available] | medium | 1 | 0 | dithiol; primary alcohol | chelator |
8-aminohexylamino camp | [no description available] | medium | 1 | 0 | | |
leucomalachite green | [no description available] | medium | 1 | 0 | benzenoid aromatic compound | |
irsogladine | [no description available] | medium | 1 | 0 | dichlorobenzene | |
allopurinol | [no description available] | medium | 6 | 0 | nucleobase analogue; organic heterobicyclic compound | antimetabolite; EC 1.17.3.2 (xanthine oxidase) inhibitor; gout suppressant; radical scavenger |
xanthine | [no description available] | medium | 2 | 0 | xanthine | Saccharomyces cerevisiae metabolite |
fusidic acid | [no description available] | medium | 3 | 0 | 11alpha-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 |
potassium chloride | [no description available] | medium | 7 | 0 | inorganic chloride; inorganic potassium salt; potassium salt | fertilizer |
triethanolamine | [no description available] | medium | 1 | 0 | amino alcohol; tertiary amino compound; triol | buffer; surfactant |
1,2-dimethylhydrazine | [no description available] | medium | 1 | 0 | hydrazines | alkylating agent; carcinogenic agent |
epigallocatechin gallate | [no description available] | medium | 2 | 0 | flavans; gallate ester; polyphenol | antineoplastic agent; antioxidant; apoptosis inducer; geroprotector; Hsp90 inhibitor; neuroprotective agent; plant metabolite |
norvancomycin | [no description available] | medium | 1 | 0 | | |
glycogen | [no description available] | medium | 2 | 0 | | |
sansalvamide a | [no description available] | medium | 1 | 0 | | |
sodium sulfite | [no description available] | medium | 1 | 0 | inorganic sodium salt; sulfite salt | food preservative; reducing agent |
cesium | [no description available] | medium | 1 | 0 | alkali metal atom | |
cesium chloride | [no description available] | medium | 1 | 0 | inorganic caesium salt; inorganic chloride | phase-transfer catalyst; vasoconstrictor agent |
g(m1) ganglioside | [no description available] | medium | 4 | 0 | alpha-N-acetylneuraminosyl-(2->3)-[beta-D-galactosyl-(1->3)-N-acetyl-beta-D-galactosaminyl-(1->4)]-beta-D-galactosyl-(1->4)-beta-D-glucosyl-(1<->1')-N-acylsphingosine; sialotetraosylceramide | |
tartrazine | [no description available] | medium | 2 | 0 | | |
tetrahydrozoline | [no description available] | medium | 1 | 1 | carboxamidine; imidazolines | nasal decongestant; sympathomimetic agent |
pyocyanine | [no description available] | medium | 2 | 0 | iminium betaine; phenazines | antibacterial agent; bacterial metabolite; biological pigment; virulence factor |
fenofibrate | [no description available] | medium | 1 | 0 | aromatic ether; chlorobenzophenone; isopropyl ester; monochlorobenzenes | antilipemic drug; environmental contaminant; geroprotector; xenobiotic |
captopril | [no description available] | medium | 6 | 2 | alkanethiol; L-proline derivative; N-acylpyrrolidine; pyrrolidinemonocarboxylic acid | antihypertensive agent; EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor |
neodymium | [no description available] | medium | 1 | 0 | f-block element atom; lanthanoid atom | |
ytterbium | [no description available] | medium | 1 | 0 | f-block element atom; lanthanoid atom | |
epiglucan | [no description available] | medium | 2 | 0 | | |
acetonitrile | [no description available] | medium | 3 | 0 | aliphatic nitrile; volatile organic compound | EC 3.5.1.4 (amidase) inhibitor; NMR chemical shift reference compound; polar aprotic solvent |
rimantadine | [no description available] | medium | 1 | 0 | alkylamine | |
3,5-diiodothyronine | [no description available] | medium | 1 | 0 | organonitrogen compound; organooxygen compound | |
inositol 1,4,5-trisphosphate | [no description available] | medium | 3 | 0 | myo-inositol trisphosphate | mouse metabolite |
triiodothyronine | [no description available] | medium | 2 | 0 | 2-halophenol; amino acid zwitterion; iodophenol; iodothyronine | human metabolite; mouse metabolite; thyroid hormone |
2-aminoadipic acid | [no description available] | medium | 1 | 0 | amino dicarboxylic acid; dicarboxylic fatty acid; non-proteinogenic alpha-amino acid | Caenorhabditis elegans metabolite; mammalian metabolite |
7-aminocephalosporanic acid | [no description available] | medium | 1 | 0 | alpha,beta-unsaturated monocarboxylic acid; amino acid zwitterion | |
1,7-phenanthroline | [no description available] | medium | 1 | 0 | phenanthroline | |
tris(4,7-diphenyl-1,10-phenanthroline)ruthenium (ii) | [no description available] | medium | 1 | 0 | ruthenium coordination entity | fluorochrome |
ethylene dichloride | [no description available] | medium | 1 | 0 | chloroethanes | hepatotoxic agent; mutagen; non-polar solvent |
methylene chloride | [no description available] | medium | 1 | 0 | chloromethanes; volatile organic compound | carcinogenic agent; polar aprotic solvent; refrigerant |
trifluoroacetic acid | [no description available] | medium | 1 | 0 | fluoroalkanoic acid | human xenobiotic metabolite; NMR chemical shift reference compound; reagent |
nitisinone | [no description available] | medium | 1 | 0 | (trifluoromethyl)benzenes; C-nitro compound; cyclohexanones; mesotrione | EC 1.13.11.27 (4-hydroxyphenylpyruvate dioxygenase) inhibitor |
tiletamine hydrochloride | [no description available] | medium | 2 | 0 | | |
serine | [no description available] | medium | 5 | 0 | L-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 |
pyridoxal phosphate | [no description available] | medium | 1 | 0 | methylpyridines; 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 |
alloxan | [no description available] | medium | 1 | 0 | pyrimidone | hyperglycemic agent; metabolite |
pimagedine | [no description available] | medium | 1 | 0 | guanidines; one-carbon compound | EC 1.14.13.39 (nitric oxide synthase) inhibitor; EC 1.4.3.4 (monoamine oxidase) inhibitor |
sodium tungstate(vi) | [no description available] | medium | 1 | 0 | inorganic sodium salt | reagent |
2-phenyl-4,4,5,5-tetramethylimidazoline-1-oxyl-3-oxide | [no description available] | medium | 2 | 0 | | |
barium chloride | [no description available] | medium | 1 | 0 | barium salt; inorganic chloride | potassium channel blocker |
methyl-thiohydantoin-tryptophan | [no description available] | medium | 1 | 0 | organonitrogen compound; organooxygen compound | |
geraniol | [no description available] | medium | 1 | 0 | 3,7-dimethylocta-2,6-dien-1-ol; monoterpenoid; primary alcohol | allergen; fragrance; plant metabolite; volatile oil component |
eucalyptol | [no description available] | medium | 1 | 0 | | |
cyclohexanol | [no description available] | medium | 1 | 0 | cyclohexanols; secondary alcohol | solvent |
brass | [no description available] | medium | 1 | 0 | | |
diaminorhodamine-4m | [no description available] | medium | 2 | 0 | | |
fibrinogen | [no description available] | medium | 5 | 0 | iditol | fungal metabolite |
alpha-cyano-4-hydroxycinnamate | [no description available] | medium | 6 | 0 | | |
1-propanol | [no description available] | medium | 3 | 0 | propan-1-ols; short-chain primary fatty alcohol | metabolite; protic solvent |
ketorolac | [no description available] | medium | 1 | 0 | amino acid; aromatic ketone; monocarboxylic acid; pyrrolizines; racemate | analgesic; cyclooxygenase 1 inhibitor; cyclooxygenase 2 inhibitor; non-steroidal anti-inflammatory drug |
nepafenac | [no description available] | medium | 1 | 0 | monocarboxylic acid amide | cyclooxygenase 1 inhibitor; cyclooxygenase 2 inhibitor; non-narcotic analgesic; non-steroidal anti-inflammatory drug; prodrug |
lysophosphatidylcholines | [no description available] | medium | 3 | 0 | 1-O-acyl-sn-glycero-3-phosphocholine | |
carbonates | [no description available] | medium | 1 | 0 | carbon oxoanion | |
quinacrine | [no description available] | medium | 4 | 0 | acridines; aromatic ether; organochlorine compound; tertiary amino compound | antimalarial; EC 1.8.1.12 (trypanothione-disulfide reductase) inhibitor |
daunorubicin | [no description available] | medium | 3 | 0 | aminoglycoside antibiotic; anthracycline; p-quinones; tetracenequinones | antineoplastic agent; bacterial metabolite |
phosphoric acid, trisodium salt | [no description available] | medium | 2 | 0 | sodium phosphate | |
thromboplastin | [no description available] | medium | 4 | 0 | | |
arginyl-glycyl-aspartyl-phenylalanine | [no description available] | medium | 1 | 0 | | |
fura-2 | [no description available] | medium | 8 | 0 | | |
threonine | [no description available] | medium | 1 | 0 | amino 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 |
fura-2-am | [no description available] | medium | 1 | 0 | | |
arsenic trioxide | [no description available] | medium | 1 | 0 | | |
2',7'-dichlorodihydrofluorescein diacetate | [no description available] | medium | 2 | 0 | | |
puromycin | [no description available] | medium | 3 | 0 | puromycins | antiinfective 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 |
4-butyrolactone | [no description available] | medium | 1 | 0 | butan-4-olide | metabolite; neurotoxin |
sulfan blue | [no description available] | medium | 2 | 0 | organic molecular entity | |
antipyrine | [no description available] | medium | 3 | 0 | pyrazolone | antipyretic; cyclooxygenase 3 inhibitor; environmental contaminant; non-narcotic analgesic; non-steroidal anti-inflammatory drug; xenobiotic |
edaravone | [no description available] | medium | 2 | 0 | pyrazolone | antioxidant; radical scavenger |
pentetic acid | [no description available] | medium | 5 | 0 | pentacarboxylic acid | copper chelator |
gramicidin a | [no description available] | medium | 1 | 0 | | |
diacetyldichlorofluorescein | [no description available] | medium | 3 | 0 | | |
diphenyleneiodonium | [no description available] | medium | 1 | 0 | organic cation | |
metallothionein | [no description available] | medium | 1 | 0 | | |
phosphorylethanolamine | [no description available] | medium | 2 | 0 | phosphoethanolamine; primary amino compound | algal metabolite; human metabolite; mouse metabolite |
cumene hydroperoxide | [no description available] | medium | 2 | 0 | peroxol | environmental contaminant; Mycoplasma genitalium metabolite; oxidising agent |
angiotensin i | [no description available] | medium | 2 | 0 | angiotensin; peptide zwitterion | human metabolite; neurotransmitter agent |
angiotensin ii, des-phe(8)- | [no description available] | medium | 1 | 0 | amino acid zwitterion; angiotensin | vasodilator agent |
epalrestat | [no description available] | medium | 1 | 1 | monocarboxylic acid; thiazolidines | EC 1.1.1.21 (aldehyde reductase) inhibitor |
rhodanine | [no description available] | medium | 1 | 1 | thiazolidinone | |
thiazolidines | [no description available] | medium | 2 | 1 | thiazolidine | |
5-methylcytosine | [no description available] | medium | 1 | 0 | methylcytosine; pyrimidines | human metabolite |
antimony | [no description available] | medium | 1 | 0 | metalloid atom; pnictogen | |
quinic acid | [no description available] | medium | 1 | 0 | | |
shikimic acid | [no description available] | medium | 1 | 0 | alpha,beta-unsaturated monocarboxylic acid; cyclohexenecarboxylic acid; hydroxy monocarboxylic acid | Escherichia coli metabolite; plant metabolite; Saccharomyces cerevisiae metabolite |
diethylhexyl phthalate | [no description available] | medium | 1 | 0 | diester; phthalate ester | androstane receptor agonist; apoptosis inhibitor; plasticiser |
2-ethylhexanol | [no description available] | medium | 1 | 0 | primary alcohol | plant metabolite; volatile oil component |
4-nonylphenol | [no description available] | medium | 1 | 0 | phenols | environmental contaminant |
1-hexanol | [no description available] | medium | 2 | 0 | hexanol; primary alcohol | alarm pheromone; antibacterial agent; fragrance; plant metabolite |
flutax 2 | [no description available] | medium | 2 | 0 | | |
dehydroascorbic acid | [no description available] | medium | 1 | 0 | dehydroascorbic acid; vitamin C | coenzyme; mouse metabolite |
dibutyl phthalate | [no description available] | medium | 1 | 0 | diester; phthalate ester | EC 3.2.1.20 (alpha-glucosidase) inhibitor; environmental contaminant; metabolite; plasticiser; teratogenic agent |
butylbenzyl phthalate | [no description available] | medium | 1 | 0 | benzyl ester | |
sodium azide | [no description available] | medium | 2 | 0 | inorganic sodium salt | antibacterial agent; explosive; mitochondrial respiratory-chain inhibitor; mutagen |
epibatidine | [no description available] | medium | 2 | 0 | | |
3-((3-cholamidopropyl)dimethylammonium)-1-propanesulfonate | [no description available] | medium | 1 | 0 | 1,1-diunsubstituted alkanesulfonate | |
u 78517f | [no description available] | medium | 2 | 0 | | |
2,2-dimethyl-5-hydroxy-1-pyrrolidinyloxy | [no description available] | medium | 1 | 0 | | |
buthionine sulfoximine | [no description available] | medium | 3 | 0 | diastereoisomeric mixture; homocysteines; non-proteinogenic alpha-amino acid; sulfoximide | EC 6.3.2.2 (glutamate--cysteine ligase) inhibitor; ferroptosis inducer |
phosphorus radioisotopes | [no description available] | medium | 5 | 1 | | |
oxalates | [no description available] | medium | 5 | 0 | | |
bis(2,4,6-trichlorophenyl)oxalate | [no description available] | medium | 1 | 0 | | |
calcimycin | [no description available] | medium | 4 | 0 | benzoxazole | |
thapsigargin | [no description available] | medium | 1 | 0 | butyrate ester; organic heterotricyclic compound; sesquiterpene lactone | calcium channel blocker; EC 3.6.3.8 (Ca(2+)-transporting ATPase) inhibitor |
diquat | [no description available] | medium | 1 | 0 | organic cation | defoliant; herbicide |
mesotrione | [no description available] | medium | 1 | 0 | aromatic ketone; beta-triketone; C-nitro compound; sulfone | carotenoid biosynthesis inhibitor; EC 1.13.11.27 (4-hydroxyphenylpyruvate dioxygenase) inhibitor; environmental contaminant; herbicide; xenobiotic |
hexaconazole | [no description available] | medium | 1 | 0 | dichlorobenzene; tertiary alcohol; triazoles | chelator |
indo-1 | [no description available] | medium | 3 | 0 | indoles | fluorochrome |
suramin | [no description available] | medium | 2 | 0 | naphthalenesulfonic 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 |
ethidium homodimer | [no description available] | medium | 2 | 0 | | |
levobunolol | [no description available] | medium | 2 | 0 | aromatic ether; cyclic ketone; propanolamine | antiglaucoma drug; beta-adrenergic antagonist |
5-dimethylamiloride | [no description available] | medium | 1 | 0 | | |
proxyl nitroxide | [no description available] | medium | 1 | 0 | aminoxyls; pyrrolidines | radical scavenger |
edda | [no description available] | medium | 1 | 0 | amino dicarboxylic acid; ethylenediamine derivative; glycine derivative; polyamino carboxylic acid | bacterial xenobiotic metabolite; chelator |
linoleic acid | [no description available] | medium | 5 | 3 | octadecadienoic acid; omega-6 fatty acid | algal metabolite; Daphnia galeata metabolite; plant metabolite |
gefarnate | [no description available] | medium | 1 | 0 | organic molecular entity | |
verlukast | [no description available] | medium | 2 | 0 | | |
n-formylmethionine leucyl-phenylalanine | [no description available] | medium | 4 | 0 | tripeptide | |
fluorescein-di-beta-d-galactopyranoside | [no description available] | medium | 1 | 0 | | |
angiotensin ii | [no description available] | medium | 9 | 0 | amino acid zwitterion; angiotensin II | human metabolite |
adenine | [no description available] | medium | 5 | 0 | 6-aminopurines; purine nucleobase | Daphnia magna metabolite; Escherichia coli metabolite; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite |
kinetin | [no description available] | medium | 1 | 0 | 6-aminopurines; furans | cytokinin; geroprotector |
endothelin-1 | [no description available] | medium | 4 | 0 | | |
6-ketocholestanol | [no description available] | medium | 1 | 0 | cholestanoid | |
phloretin | [no description available] | medium | 2 | 0 | dihydrochalcones | antineoplastic agent; plant metabolite |
yohimbine | [no description available] | medium | 1 | 0 | methyl 17-hydroxy-20xi-yohimban-16-carboxylate | alpha-adrenergic antagonist; dopamine receptor D2 antagonist; serotonergic antagonist |
n-(4-amino-2-methylquinolin-6-yl)-2-(4-ethylphenoxymethyl)benzamide | [no description available] | medium | 1 | 0 | aminoquinoline | |
alprostadil | [no description available] | medium | 4 | 2 | prostaglandins E | anticoagulant; human metabolite; platelet aggregation inhibitor; vasodilator agent |
magnesium sulfate | [no description available] | medium | 2 | 0 | magnesium salt; metal sulfate; organic magnesium salt | anaesthetic; analgesic; anti-arrhythmia drug; anticonvulsant; calcium channel blocker; cardiovascular drug; fertilizer; tocolytic agent |
butaprost | [no description available] | medium | 1 | 0 | | |
leptin | [no description available] | medium | 3 | 0 | | |
carbocysteine | [no description available] | medium | 2 | 0 | L-cysteine thioether; non-proteinogenic L-alpha-amino acid | mucolytic |
thymine | [no description available] | medium | 1 | 0 | pyrimidine nucleobase; pyrimidone | Escherichia coli metabolite; human metabolite; mouse metabolite |
epsilon-(gamma-glutamyl)-lysine | [no description available] | medium | 1 | 0 | L-alpha-amino acid zwitterion; N(6)-acyl-L-lysine | |
bromosuccinimide | [no description available] | medium | 2 | 0 | dicarboximide; organobromine compound; pyrrolidinone | reagent |
ribose | [no description available] | medium | 2 | 0 | D-ribose; ribopyranose | |
methyl red | [no description available] | medium | 3 | 0 | | |
isoproterenol | [no description available] | medium | 6 | 0 | catechols; secondary alcohol; secondary amino compound | beta-adrenergic agonist; bronchodilator agent; cardiotonic drug; sympathomimetic agent |
pentobarbital | [no description available] | medium | 1 | 0 | barbiturates | GABAA receptor agonist |
mustard gas | [no description available] | medium | 1 | 0 | ethyl sulfide; organochlorine compound | alkylating agent; carcinogenic agent; vesicant |
acridines | [no description available] | medium | 7 | 0 | acridines; mancude organic heterotricyclic parent; polycyclic heteroarene | genotoxin |
iodine | [no description available] | medium | 8 | 0 | diatomic iodine | nutrient |
histamine | [no description available] | medium | 13 | 1 | aralkylamino compound; imidazoles | human metabolite; mouse metabolite; neurotransmitter |
phosphorus | [no description available] | medium | 2 | 0 | monoatomic phosphorus; nonmetal atom; pnictogen | macronutrient |
cyanates | [no description available] | medium | 2 | 0 | | |
2-diethylaminoethanol | [no description available] | medium | 2 | 0 | ethanolamines; primary alcohol; tertiary amino compound | |
ethacridine | [no description available] | medium | 1 | 0 | acridines | |
osmium tetroxide | [no description available] | medium | 1 | 0 | osmium coordination entity | fixative; histological dye; oxidising agent; poison |
chlorine | [no description available] | medium | 3 | 0 | diatomic chlorine; gas molecular entity | bleaching agent |
barium sulfate | [no description available] | medium | 1 | 0 | barium salt; inorganic barium salt; metal sulfate | radioopaque medium |
barium | [no description available] | medium | 2 | 0 | alkaline earth metal atom; elemental barium | |
dehydrocholic acid | [no description available] | medium | 2 | 0 | 12-oxo steroid; 3-oxo-5beta-steroid; 7-oxo steroid; oxo-5beta-cholanic acid | gastrointestinal drug |
alcian blue | [no description available] | medium | 1 | 0 | | |
reserpine | [no description available] | medium | 1 | 0 | alkaloid 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 |
hydrochlorothiazide | [no description available] | medium | 1 | 0 | benzothiadiazine; organochlorine compound; sulfonamide | antihypertensive agent; diuretic; environmental contaminant; xenobiotic |
griseofulvin | [no description available] | medium | 1 | 0 | 1-benzofurans; antibiotic antifungal drug; benzofuran antifungal drug; organochlorine compound; oxaspiro compound | antibacterial agent; Penicillium metabolite |
chlortetracycline | [no description available] | medium | 1 | 0 | | |
butacaine | [no description available] | medium | 1 | 0 | benzoate ester | |
4-aminobenzoic acid | [no description available] | medium | 3 | 0 | aminobenzoate; aromatic amino-acid anion | Escherichia coli metabolite; plant metabolite; Saccharomyces cerevisiae metabolite |
nitrofurazone | [no description available] | medium | 1 | 0 | | |
atractyloside | [no description available] | medium | 1 | 0 | | |
flurbiprofen | [no description available] | medium | 6 | 5 | fluorobiphenyl; monocarboxylic acid | antipyretic; EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor; non-narcotic analgesic; non-steroidal anti-inflammatory drug |
phosphothreonine | [no description available] | medium | 1 | 0 | L-threonine derivative; non-proteinogenic L-alpha-amino acid; O-phosphoamino acid | Escherichia coli metabolite |
phorbol-12-myristate | [no description available] | medium | 1 | 0 | | |
ibopamine | [no description available] | medium | 1 | 1 | benzoate ester; phenols | |
deoxyepinephrine | [no description available] | medium | 1 | 1 | catecholamine | |
dapiprazole | [no description available] | medium | 1 | 1 | N-alkylpiperazine; N-arylpiperazine; pyridines | alpha-adrenergic antagonist; antipsychotic agent; miotic; ophthalmology drug |
xylometazoline | [no description available] | medium | 1 | 0 | alkylbenzene | |
1-o-pentylglycerol | [no description available] | medium | 1 | 0 | | |
tocopherols | [no description available] | medium | 1 | 0 | | |
2,2'-azobis(2-amidinopropane) | [no description available] | medium | 3 | 0 | monoazo compound | |
tocotrienols | [no description available] | medium | 1 | 0 | diterpenoid | |
carbachol | [no description available] | medium | 2 | 0 | ammonium salt; carbamate ester | cardiotonic drug; miotic; muscarinic agonist; nicotinic acetylcholine receptor agonist; non-narcotic analgesic |
trans-2,3',4,5'-tetrahydroxystilbene | [no description available] | medium | 1 | 0 | stilbenoid | |
chlorobutanol | [no description available] | medium | 3 | 0 | tertiary alcohol | |
epicatechin gallate | [no description available] | medium | 1 | 0 | catechin; gallate ester; polyphenol | EC 3.2.1.1 (alpha-amylase) inhibitor; EC 3.2.1.20 (alpha-glucosidase) inhibitor; metabolite |
bimatoprost | [no description available] | medium | 1 | 1 | monocarboxylic acid amide | antiglaucoma drug; antihypertensive agent |
cloprostenol | [no description available] | medium | 1 | 1 | prostanoid | |
travoprost | [no description available] | medium | 1 | 1 | (trifluoromethyl)benzenes; isopropyl ester; prostaglandins Falpha | antiglaucoma drug; antihypertensive agent; ophthalmology drug; prodrug; prostaglandin receptor agonist |
2,4-pyridinedicarboxylic acid | [no description available] | medium | 1 | 0 | pyridinedicarboxylic acid | |
potassium permanganate | [no description available] | medium | 1 | 0 | | |
potassium chromate(vi) | [no description available] | medium | 1 | 0 | potassium salt | carcinogenic agent; oxidising agent |
phenytoin | [no description available] | medium | 2 | 0 | imidazolidine-2,4-dione | anticonvulsant; drug allergen; sodium channel blocker; teratogenic agent |
silver nitrate | [no description available] | medium | 2 | 0 | inorganic nitrate salt; silver salt | astringent |
chromates | [no description available] | medium | 1 | 0 | chromium oxoanion; divalent inorganic anion | oxidising agent |
masoprocol | [no description available] | medium | 1 | 0 | nordihydroguaiaretic acid | antineoplastic agent; hypoglycemic agent; lipoxygenase inhibitor; metabolite |
brefeldin a | [no description available] | medium | 3 | 0 | macrolide antibiotic | Penicillium metabolite |
yo-pro 1 | [no description available] | medium | 1 | 0 | cyanine dye; organic iodide salt; quaternary ammonium salt | fluorochrome |
gamma-cyclodextrin | [no description available] | medium | 1 | 0 | cyclodextrin | |
benzoxazoles | [no description available] | medium | 1 | 0 | 1,3-benzoxazoles; mancude organic heterobicyclic parent | |
3beta-(n-(n',n'-dimethylaminoethane)carbamoyl)cholesterol | [no description available] | medium | 1 | 0 | | |
pyrazines | [no description available] | medium | 1 | 0 | diazine; pyrazines | Daphnia magna metabolite |
2-methyl-6-(4-methoxyphenyl)-3,7-dihydroimidazo(1,2-alpha)pyrazin-3-one | [no description available] | medium | 1 | 0 | | |
chitotriose | [no description available] | medium | 1 | 0 | | |
triptolide | [no description available] | medium | 1 | 0 | diterpenoid; epoxide; gamma-lactam; organic heteroheptacyclic compound | antispermatogenic agent; plant metabolite |
phenanthrenes | [no description available] | medium | 2 | 0 | | |
brimonidine tartrate | [no description available] | medium | 4 | 2 | | |
cortisone | [no description available] | medium | 1 | 0 | 11-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 |
dichlorvos | [no description available] | medium | 1 | 0 | alkenyl 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 |
carbofuran | [no description available] | medium | 1 | 0 | 1-benzofurans; carbamate ester | acaricide; agrochemical; avicide; carbamate insecticide; EC 3.1.1.7 (acetylcholinesterase) inhibitor; EC 3.1.1.8 (cholinesterase) inhibitor; nematicide |
1,2-dielaidoylphosphatidylethanolamine | [no description available] | medium | 2 | 0 | | |
o(6)-benzylguanine | [no description available] | medium | 1 | 0 | | |
flavin-adenine dinucleotide | [no description available] | medium | 1 | 0 | flavin adenine dinucleotide; vitamin B2 | cofactor; Escherichia coli metabolite; human metabolite; mouse metabolite; prosthetic group |
flavin mononucleotide | [no description available] | medium | 2 | 0 | | |
gemfibrozil | [no description available] | medium | 1 | 0 | aromatic ether | antilipemic drug |
acyclovir | [no description available] | medium | 2 | 0 | 2-aminopurines; oxopurine | antimetabolite; antiviral drug |
dinitrobenzenes | [no description available] | medium | 1 | 0 | | |
wrenchnolol | [no description available] | medium | 1 | 0 | | |
adamanolol | [no description available] | medium | 1 | 0 | | |
mifepristone | [no description available] | medium | 1 | 0 | 3-oxo-Delta(4) steroid; acetylenic compound; tertiary amino compound | abortifacient; contraceptive drug; hormone antagonist; synthetic oral contraceptive |
pimonidazole | [no description available] | medium | 1 | 0 | | |
o-(chloroacetylcarbamoyl)fumagillol | [no description available] | medium | 1 | 0 | carbamate 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 |
sesquiterpenes | [no description available] | medium | 1 | 0 | | |
azomycin | [no description available] | medium | 1 | 0 | C-nitro compound; imidazoles | antitubercular agent |
midazolam | [no description available] | medium | 1 | 0 | imidazobenzodiazepine; monofluorobenzenes; organochlorine compound | anticonvulsant; antineoplastic agent; anxiolytic drug; apoptosis inducer; central nervous system depressant; GABAA receptor agonist; general anaesthetic; muscle relaxant; sedative |
p-aminohippuric acid | [no description available] | medium | 13 | 0 | N-acylglycine | Daphnia magna metabolite |
clarithromycin | [no description available] | medium | 1 | 0 | macrolide antibiotic | antibacterial drug; environmental contaminant; protein synthesis inhibitor; xenobiotic |
phenformin | [no description available] | medium | 1 | 0 | biguanides | antineoplastic agent; geroprotector; hypoglycemic agent |
tetrodotoxin | [no description available] | medium | 2 | 0 | azatetracycloalkane; oxatetracycloalkane; quinazoline alkaloid | animal metabolite; bacterial metabolite; marine metabolite; neurotoxin; voltage-gated sodium channel blocker |
estrone sulfate | [no description available] | medium | 1 | 0 | 17-oxo steroid; steroid sulfate | human metabolite; mouse metabolite |
estrone | [no description available] | medium | 1 | 0 | 17-oxo steroid; 3-hydroxy steroid; phenolic steroid; phenols | antineoplastic agent; bone density conservation agent; estrogen; human metabolite; mouse metabolite |
sea 0400 | [no description available] | medium | 1 | 0 | | |
7-methylguanosine-5'-monophosphate | [no description available] | medium | 1 | 0 | organophosphate oxoanion | |
ccf 2 | [no description available] | medium | 1 | 0 | | |
caffeic acid | [no description available] | medium | 1 | 0 | caffeic acid | geroprotector; mouse metabolite |
chlorogenic acid | [no description available] | medium | 1 | 0 | cinnamate ester; tannin | food component; plant metabolite |
sildenafil citrate | [no description available] | medium | 1 | 0 | citrate salt | EC 3.1.4.35 (3',5'-cyclic-GMP phosphodiesterase) inhibitor; vasodilator agent |
1-methyl-3-isobutylxanthine | [no description available] | medium | 2 | 0 | 3-isobutyl-1-methylxanthine | |
dizocilpine maleate | [no description available] | medium | 2 | 0 | maleate salt; tetracyclic antidepressant | anaesthetic; anticonvulsant; neuroprotective agent; nicotinic antagonist; NMDA receptor antagonist |
fast green fcf | [no description available] | medium | 1 | 0 | organic sodium salt | fluorochrome; food colouring; histological dye |
amido black | [no description available] | medium | 1 | 0 | | |
tetraethylammonium | [no description available] | medium | 2 | 0 | quaternary ammonium ion | |
phosphotyrosine | [no description available] | medium | 4 | 0 | L-tyrosine derivative; non-proteinogenic L-alpha-amino acid; O(4)-phosphotyrosine | Escherichia coli metabolite; immunogen |
chloramphenicol | [no description available] | medium | 4 | 0 | C-nitro compound; carboxamide; diol; organochlorine compound | antibacterial drug; antimicrobial agent; Escherichia coli metabolite; geroprotector; Mycoplasma genitalium metabolite; protein synthesis inhibitor |
technetium tc 99m sulfur colloid | [no description available] | medium | 2 | 0 | | |
11-cis-retinal | [no description available] | medium | 4 | 0 | retinal | chromophore; human metabolite; mouse metabolite |
trinitrotoluene | [no description available] | medium | 1 | 0 | trinitrotoluene | explosive |
imatinib mesylate | [no description available] | medium | 1 | 0 | methanesulfonate salt | anticoronaviral agent; antineoplastic agent; apoptosis inducer; tyrosine kinase inhibitor |
hoe 33342 | [no description available] | medium | 4 | 0 | | |
thromboxane b2 | [no description available] | medium | 2 | 0 | thromboxanes B | human metabolite; mouse metabolite |
nocodazole | [no description available] | medium | 6 | 0 | aromatic ketone; benzimidazoles; carbamate ester; thiophenes | antimitotic; antineoplastic agent; microtubule-destabilising agent; tubulin modulator |
tetradecanoylphorbol acetate | [no description available] | medium | 11 | 0 | acetate 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 |
chlorpromazine | [no description available] | medium | 4 | 0 | organochlorine compound; phenothiazines; tertiary amine | anticoronaviral agent; antiemetic; dopaminergic antagonist; EC 3.4.21.26 (prolyl oligopeptidase) inhibitor; phenothiazine antipsychotic drug |
cyclopentane | [no description available] | medium | 2 | 0 | cycloalkane; cyclopentanes; volatile organic compound | non-polar solvent |
6-mercapto-1-hexanol | [no description available] | medium | 1 | 0 | | |
alpha-chymotrypsin | [no description available] | medium | 4 | 0 | | |
4-chloro-7-nitrobenzofurazan | [no description available] | medium | 3 | 0 | benzoxadiazole; C-nitro compound; organochlorine compound | EC 1.4.3.4 (monoamine oxidase) inhibitor; EC 3.6.1.3 (adenosinetriphosphatase) inhibitor; fluorescent probe; fluorochrome |
morpholinopropane sulfonic acid | [no description available] | medium | 1 | 0 | MOPS; morpholines; organosulfonic acid | |
mercuric oxide | [no description available] | medium | 1 | 0 | | |
bromine | [no description available] | medium | 2 | 0 | diatomic bromine | |
flavone | [no description available] | medium | 1 | 0 | flavones | metabolite; nematicide |
amphotericin b | [no description available] | medium | 1 | 0 | antibiotic antifungal drug; macrolide antibiotic; polyene antibiotic | antiamoebic agent; antiprotozoal drug; bacterial metabolite |
cyclothiazide | [no description available] | medium | 1 | 0 | benzothiadiazine | antihypertensive agent; diuretic |
picrotoxin | [no description available] | medium | 1 | 0 | | |
strychnine | [no description available] | medium | 1 | 0 | monoterpenoid indole alkaloid; organic heteroheptacyclic compound | avicide; cholinergic antagonist; glycine receptor antagonist; neurotransmitter agent; rodenticide |
gyki 53655 | [no description available] | medium | 1 | 0 | | |
carmustine | [no description available] | medium | 1 | 0 | N-nitrosoureas; organochlorine compound | alkylating agent; antineoplastic agent |
bradykinin | [no description available] | medium | 6 | 0 | oligopeptide | human blood serum metabolite; vasodilator agent |
lysyl-aspartyl-glutamyl-leucine | [no description available] | medium | 1 | 0 | | |
zeolites | [no description available] | medium | 1 | 0 | | |
mercuric chloride | [no description available] | medium | 2 | 0 | mercury coordination entity | sensitiser |
Brilliant Blue | [no description available] | medium | 1 | 0 | organic molecular entity | |
cytidine | [no description available] | medium | 1 | 0 | cytidines | Escherichia coli metabolite; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite |
cresol red | [no description available] | medium | 1 | 0 | 2,1-benzoxathiole; arenesulfonate ester; polyphenol; sultone | acid-base indicator; dye; two-colour indicator |
phosphoramidite | [no description available] | medium | 1 | 0 | | |
h 89 | [no description available] | medium | 1 | 0 | N-[2-(4-bromocinnamylamino)ethyl]isoquinoline-5-sulfonamide | |
risarestat | [no description available] | medium | 1 | 1 | thiazolidinone | |
guanosine | [no description available] | medium | 2 | 0 | guanosines; purines D-ribonucleoside | fundamental metabolite |
ribosomal protein l7-l12 | [no description available] | medium | 2 | 0 | | |
nateglinide | [no description available] | medium | 3 | 0 | phenylalanine derivative | |
4-(5-benzo(1,3)dioxol-5-yl-4-pyridin-2-yl-1h-imidazol-2-yl)benzamide | [no description available] | medium | 1 | 0 | benzamides; benzodioxoles; imidazoles; pyridines | EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor |
1,2-diaminobenzene | [no description available] | medium | 1 | 0 | phenylenediamine | hydrogen donor |
1,3-dipropyl-8-cyclopentylxanthine | [no description available] | medium | 1 | 0 | oxopurine | adenosine A1 receptor antagonist; EC 3.1.4.* (phosphoric diester hydrolase) inhibitor |
fluorescein glucuronide | [no description available] | medium | 32 | 1 | | |
zm 241385 | [no description available] | medium | 1 | 0 | diamino-1,3,5-triazine | |
mrs 1191 | [no description available] | medium | 1 | 0 | cinnamate ester | |
dihydropyridines | [no description available] | medium | 1 | 0 | | |
benzenesulfonyl chloride | [no description available] | medium | 1 | 0 | | |
dithionitrobenzoic acid | [no description available] | medium | 1 | 0 | nitrobenzoic acid; organic disulfide | indicator |
guanosine diphosphate | [no description available] | medium | 1 | 0 | guanosine 5'-phosphate; purine ribonucleoside 5'-diphosphate | Escherichia coli metabolite; mouse metabolite; uncoupling protein inhibitor |
glycidyl methacrylate | [no description available] | medium | 1 | 0 | enoate ester; epoxide | |
ethylene dimethacrylate | [no description available] | medium | 1 | 0 | enoate ester | allergen; cross-linking reagent; polymerisation monomer |
4-carboxyfluorescein | [no description available] | medium | 5 | 0 | monocarboxylic acid | fluorochrome |
2-nitrophenyl-egta | [no description available] | medium | 1 | 0 | | |
carbobenzoxyproline | [no description available] | medium | 1 | 0 | | |
isoleucine | [no description available] | medium | 1 | 0 | aspartate 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 |
ethylnitrosourea | [no description available] | medium | 1 | 0 | N-nitrosoureas | alkylating agent; carcinogenic agent; genotoxin; mutagen |
trimethoprim | [no description available] | medium | 2 | 0 | aminopyrimidine; methoxybenzenes | antibacterial drug; diuretic; drug allergen; EC 1.5.1.3 (dihydrofolate reductase) inhibitor; environmental contaminant; xenobiotic |
pyrimethamine | [no description available] | medium | 1 | 0 | aminopyrimidine; monochlorobenzenes | antimalarial; antiprotozoal drug; EC 1.5.1.3 (dihydrofolate reductase) inhibitor |
transportan | [no description available] | medium | 2 | 0 | | |
4-nitrophenol | [no description available] | medium | 1 | 0 | 4-nitrophenols | human xenobiotic metabolite; mouse metabolite |
nitrophenols | [no description available] | medium | 1 | 0 | | |
beryllium | [no description available] | medium | 1 | 0 | alkaline earth metal atom; elemental beryllium; metal allergen | adjuvant; carcinogenic agent; epitope |
beryllium fluoride | [no description available] | medium | 1 | 0 | beryllium molecular entity; fluoride salt | |
putrescine | [no description available] | medium | 3 | 0 | alkane-alpha,omega-diamine | antioxidant; fundamental metabolite |
trinitrobenzenesulfonic acid | [no description available] | medium | 2 | 0 | arenesulfonic acid; C-nitro compound | epitope; explosive; reagent |
sinistrin | [no description available] | medium | 2 | 0 | | |
6-carboxy-x-rhodamine | [no description available] | medium | 1 | 0 | | |
probenecid | [no description available] | medium | 18 | 1 | benzoic acids; sulfonamide | uricosuric drug |
digitoxin | [no description available] | medium | 1 | 0 | cardenolide glycoside | EC 3.6.3.9 (Na(+)/K(+)-transporting ATPase) inhibitor |
digoxin | [no description available] | medium | 3 | 0 | cardenolide glycoside; steroid saponin | anti-arrhythmia drug; cardiotonic drug; EC 3.6.3.9 (Na(+)/K(+)-transporting ATPase) inhibitor; epitope |
dimethyldioctadecylammonium | [no description available] | medium | 1 | 0 | | |
curdlan | [no description available] | medium | 1 | 0 | hexose | |
nitrilotriacetic acid | [no description available] | medium | 3 | 0 | NTA; tricarboxylic acid | carcinogenic agent; nephrotoxic agent |
beta-lactams | [no description available] | medium | 1 | 0 | beta-lactam antibiotic allergen; beta-lactam | |
adenosine 5'-o-(3-thiotriphosphate) | [no description available] | medium | 2 | 0 | nucleoside triphosphate analogue | |
suberic acid | [no description available] | medium | 1 | 0 | alpha,omega-dicarboxylic acid; dicarboxylic fatty acid | human metabolite |
quinalphos | [no description available] | medium | 1 | 0 | organic thiophosphate; organothiophosphate insecticide | acaricide; agrochemical; EC 3.1.1.7 (acetylcholinesterase) inhibitor |
carmine | [no description available] | medium | 1 | 0 | | |
n-(2-cyclohexyloxy-4-nitrophenyl)methanesulfonamide | [no description available] | medium | 1 | 0 | aromatic ether; C-nitro compound; sulfonamide | antineoplastic agent; cyclooxygenase 2 inhibitor |
isoprene | [no description available] | medium | 1 | 0 | alkadiene; hemiterpene; volatile organic compound | plant metabolite |
urethane | [no description available] | medium | 1 | 0 | carbamate ester | fungal metabolite; mutagen |
1-octanol | [no description available] | medium | 2 | 0 | octanol; primary alcohol | antifungal agent; bacterial metabolite; fuel additive; kairomone; plant metabolite |
sapropterin | [no description available] | medium | 1 | 0 | 5,6,7,8-tetrahydrobiopterin | coenzyme; cofactor; diagnostic agent; human metabolite |
calmidazolium | [no description available] | medium | 1 | 0 | imidazolium ion | apoptosis inducer; calmodulin antagonist |
melatonin | [no description available] | medium | 1 | 0 | acetamides; tryptamines | anticonvulsant; central nervous system depressant; geroprotector; hormone; human metabolite; immunological adjuvant; mouse metabolite; radical scavenger |
uridine diphosphate | [no description available] | medium | 1 | 0 | pyrimidine ribonucleoside 5'-diphosphate; uridine 5'-phosphate | Escherichia coli metabolite; mouse metabolite |
apyrase | [no description available] | medium | 1 | 0 | | |
zinc chloride | [no description available] | medium | 1 | 0 | inorganic chloride; zinc molecular entity | astringent; disinfectant; EC 5.3.3.5 (cholestenol Delta-isomerase) inhibitor; Lewis acid |
5'-adenylyl (beta,gamma-methylene)diphosphonate | [no description available] | medium | 1 | 0 | nucleoside triphosphate analogue | |
arl-67156 | [no description available] | medium | 1 | 0 | | |
bilirubin | [no description available] | medium | 4 | 0 | biladienes; dicarboxylic acid | antioxidant; human metabolite; mouse metabolite |
7432 s | [no description available] | medium | 1 | 0 | cephalosporin; dicarboxylic acid | antibacterial drug |
4-aminobenzoic acid | [no description available] | medium | 6 | 0 | aminobenzoic acid; aromatic amino-acid zwitterion | allergen; Escherichia coli metabolite; plant metabolite |
succinic acid | [no description available] | medium | 2 | 0 | alpha,omega-dicarboxylic acid; C4-dicarboxylic acid | anti-ulcer drug; fundamental metabolite; micronutrient; nutraceutical; radiation protective agent |
polyethylene glycol 300 | [no description available] | medium | 1 | 0 | poly(ethylene glycol) | |
n-heptane | [no description available] | medium | 1 | 0 | alkane; volatile organic compound | non-polar solvent; plant metabolite |
ethylene oxide | [no description available] | medium | 1 | 0 | gas molecular entity; oxacycle; saturated organic heteromonocyclic parent | allergen; mouse metabolite; mutagen |
nystatin a1 | [no description available] | medium | 3 | 0 | nystatins | |
glyoxal bis(2-hydroxyanil) | [no description available] | medium | 1 | 0 | | |
aminocaproic acid | [no description available] | medium | 1 | 0 | amino acid zwitterion; epsilon-amino acid; omega-amino fatty acid | antifibrinolytic drug; hematologic agent; metabolite |
ethylmaleimide | [no description available] | medium | 2 | 0 | maleimides | anticoronaviral 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 |
phenylmethylsulfonyl fluoride | [no description available] | medium | 1 | 0 | acyl fluoride | serine proteinase inhibitor |
pitavastatin | [no description available] | medium | 1 | 0 | cyclopropanes; dihydroxy monocarboxylic acid; monofluorobenzenes; quinolines; statin (synthetic) | antioxidant |
calcium dobesilate | [no description available] | medium | 1 | 1 | | |
chondroitin | [no description available] | medium | 1 | 0 | | |
pyranine | [no description available] | medium | 7 | 0 | organic sodium salt | fluorochrome |
hexacyanoferrate iii | [no description available] | medium | 1 | 0 | | |
diethylstilbestrol | [no description available] | medium | 1 | 0 | olefinic 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 |
metoprolol | [no description available] | medium | 1 | 0 | aromatic ether; propanolamine; secondary alcohol; secondary amino compound | antihypertensive agent; beta-adrenergic antagonist; environmental contaminant; geroprotector; xenobiotic |
fulvestrant | [no description available] | medium | 1 | 0 | 17beta-hydroxy steroid; 3-hydroxy steroid; organofluorine compound; sulfoxide | antineoplastic agent; estrogen antagonist; estrogen receptor antagonist |
sr 59230a | [no description available] | medium | 1 | 0 | | |
metoclopramide | [no description available] | medium | 2 | 0 | benzamides; monochlorobenzenes; substituted aniline; tertiary amino compound | antiemetic; dopaminergic antagonist; environmental contaminant; gastrointestinal drug; xenobiotic |
su 11248 | [no description available] | medium | 1 | 0 | monocarboxylic acid amide; pyrroles | angiogenesis inhibitor; antineoplastic agent; EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor; immunomodulator; neuroprotective agent; vascular endothelial growth factor receptor antagonist |
s-acetylmercaptosuccinic anhydride | [no description available] | medium | 1 | 0 | | |
beta-escin | [no description available] | medium | 1 | 0 | | |
tetraethoxysilane | [no description available] | medium | 1 | 0 | | |
celecoxib | [no description available] | medium | 1 | 0 | organofluorine compound; pyrazoles; sulfonamide; toluenes | cyclooxygenase 2 inhibitor; geroprotector; non-narcotic analgesic; non-steroidal anti-inflammatory drug |
gallein | [no description available] | medium | 1 | 0 | 2-benzofurans; gamma-lactone; organic heteropentacyclic compound; oxaspiro compound; polyphenol; xanthene dye | fluorochrome; G-protein-coupled receptor antagonist; histological dye |
adenosine diphosphate ribose | [no description available] | medium | 1 | 0 | ADP-sugar | Escherichia coli metabolite; mouse metabolite |
valine | [no description available] | medium | 2 | 0 | L-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 |
8-aminoquinoline | [no description available] | medium | 1 | 0 | | |
bisphenol a-glycidyl methacrylate | [no description available] | medium | 1 | 0 | diarylmethane | |
tetramethoxysilane | [no description available] | medium | 1 | 0 | | |
methyltrimethoxysilane | [no description available] | medium | 1 | 0 | | |
ammonium hydroxide | [no description available] | medium | 2 | 0 | azane; 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 |
methanethiosulfonate | [no description available] | medium | 1 | 0 | | |
divinyl sulfone | [no description available] | medium | 1 | 0 | sulfone | cross-linking reagent |
cystine | [no description available] | medium | 1 | 0 | | |
s-nitroso-n-acetylpenicillamine | [no description available] | medium | 3 | 0 | nitroso compound; nitrosothio compound | nitric oxide donor; vasodilator agent |
hydroxyethyl methacrylate | [no description available] | medium | 3 | 0 | enoate ester | allergen; polymerisation monomer |
pregnanolone | [no description available] | medium | 1 | 0 | 3-hydroxy-5beta-pregnan-20-one; 3alpha-hydroxy steroid | human metabolite; intravenous anaesthetic; sedative |
brl 37344 | [no description available] | medium | 1 | 0 | monocarboxylic acid | |
rhod-2 | [no description available] | medium | 1 | 0 | | |
1-ethyl-3-(3-dimethylaminoethyl)carbodiimide | [no description available] | medium | 1 | 0 | | |
carbodiimides | [no description available] | medium | 2 | 0 | carbodiimide | |
indapamide | [no description available] | medium | 1 | 0 | indoles; organochlorine compound; sulfonamide | antihypertensive agent; diuretic |
lactose | [no description available] | medium | 4 | 0 | lactose | |
3-azidotyrosine | [no description available] | medium | 1 | 0 | | |
ethacrynic acid | [no description available] | medium | 1 | 0 | aromatic ether; aromatic ketone; dichlorobenzene; monocarboxylic acid | EC 2.5.1.18 (glutathione transferase) inhibitor; ion transport inhibitor; loop diuretic |
1-methyl-4-phenylpyridinium | [no description available] | medium | 1 | 0 | pyridinium ion | apoptosis inducer; herbicide; human xenobiotic metabolite; neurotoxin |
leukotriene c4 | [no description available] | medium | 1 | 0 | leukotriene | bronchoconstrictor agent; human metabolite; mouse metabolite |
methacrylic acid | [no description available] | medium | 1 | 0 | alpha,beta-unsaturated monocarboxylic acid | |
ethyl acrylate | [no description available] | medium | 1 | 0 | enoate ester | |
tetrahydrofuran | [no description available] | medium | 1 | 0 | cyclic ether; oxolanes; saturated organic heteromonocyclic parent; volatile organic compound | polar aprotic solvent |
papa nonoate | [no description available] | medium | 1 | 0 | alkylamine | |
sodium hypochlorite | [no description available] | medium | 1 | 0 | inorganic sodium salt | bleaching agent; disinfectant |
pd 98059 | [no description available] | medium | 1 | 0 | aromatic amine; monomethoxyflavone | EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor; geroprotector |
bromochloroacetic acid | [no description available] | medium | 4 | 0 | 2-bromocarboxylic acid; monocarboxylic acid; organochlorine compound | |
methacholine chloride | [no description available] | medium | 1 | 0 | quaternary ammonium salt | |
acetovanillone | [no description available] | medium | 1 | 0 | acetophenones; aromatic ketone; methyl ketone | antirheumatic drug; EC 1.6.3.1. [NAD(P)H oxidase (H2O2-forming)] inhibitor; non-narcotic analgesic; non-steroidal anti-inflammatory drug; peripheral nervous system drug; plant metabolite |
oxypurinol | [no description available] | medium | 1 | 0 | pyrazolopyrimidine | drug metabolite; EC 1.17.3.2 (xanthine oxidase) inhibitor |
glutathione disulfide | [no description available] | medium | 2 | 0 | glutathione derivative; organic disulfide | Escherichia coli metabolite; mouse metabolite |
methylprednisolone | [no description available] | medium | 1 | 0 | 6-methylprednisolone; primary alpha-hydroxy ketone; tertiary alpha-hydroxy ketone | adrenergic agent; anti-inflammatory drug; antiemetic; environmental contaminant; neuroprotective agent; xenobiotic |
boric acid | [no description available] | medium | 1 | 0 | boric acids | astringent |
thalidomide | [no description available] | medium | 1 | 0 | phthalimides; piperidones | |
spermidine | [no description available] | medium | 2 | 0 | polyazaalkane; triamine | autophagy inducer; fundamental metabolite; geroprotector |
cytochalasin d | [no description available] | medium | 4 | 0 | | |
ethylene | [no description available] | medium | 1 | 0 | alkene; gas molecular entity | plant hormone; refrigerant |
naltrexone | [no description available] | medium | 3 | 0 | cyclopropanes; morphinane-like compound; organic heteropentacyclic compound | antidote to opioid poisoning; central nervous system depressant; environmental contaminant; mu-opioid receptor antagonist; xenobiotic |
naloxone | [no description available] | medium | 3 | 0 | morphinane alkaloid; organic heteropentacyclic compound; tertiary alcohol | antidote to opioid poisoning; central nervous system depressant; mu-opioid receptor antagonist |
3-(trimethoxysilyl)propylamine | [no description available] | medium | 1 | 0 | | |
1,2-bis(2-aminophenoxy)ethane n,n,n',n'-tetraacetic acid acetoxymethyl ester | [no description available] | medium | 1 | 0 | | |
abscisic acid | [no description available] | medium | 3 | 0 | 2-trans-abscisic acid | |
dihydrorhodamine 123 | [no description available] | medium | 1 | 0 | | |
dihydrorhodamine 6g | [no description available] | medium | 1 | 0 | | |
4-bis(2-methylstyryl)benzene | [no description available] | medium | 1 | 0 | | |
sarkosyl | [no description available] | medium | 1 | 0 | | |
rotenone | [no description available] | medium | 3 | 0 | organic heteropentacyclic compound; rotenones | antineoplastic agent; metabolite; mitochondrial NADH:ubiquinone reductase inhibitor; phytogenic insecticide; piscicide; toxin |
diacetyl | [no description available] | medium | 2 | 0 | alpha-diketone | Escherichia coli metabolite; Saccharomyces cerevisiae metabolite |
diacetylmonoxime | [no description available] | medium | 2 | 0 | | |
etoposide | [no description available] | medium | 2 | 0 | beta-D-glucoside; furonaphthodioxole; organic heterotetracyclic compound | antineoplastic agent; DNA synthesis inhibitor |
glycopyrrolate | [no description available] | medium | 1 | 0 | organic bromide salt; quaternary ammonium salt | |
methylphosphonic acid | [no description available] | medium | 1 | 0 | one-carbon compound; phosphonic acids | |
alpha-linolenic acid | [no description available] | medium | 1 | 0 | linolenic acid; omega-3 fatty acid | micronutrient; mouse metabolite; nutraceutical |
7-fluoro-4-nitrobenzo-2-oxa-1,3-diazole | [no description available] | medium | 1 | 0 | | |
pyrrhocoricin protein, pyrrhocoris apterus | [no description available] | medium | 1 | 0 | | |
myelin basic protein | [no description available] | medium | 1 | 0 | | |
2,2'-azino-di-(3-ethylbenzothiazoline)-6-sulfonic acid | [no description available] | medium | 1 | 0 | | |
pinocembrin | [no description available] | medium | 1 | 0 | (2S)-flavan-4-one; dihydroxyflavanone | antineoplastic agent; antioxidant; metabolite; neuroprotective agent; vasodilator agent |
losartan potassium | [no description available] | medium | 1 | 0 | | |
acetyl phosphate | [no description available] | medium | 2 | 0 | acyl monophosphate | Escherichia coli metabolite; human metabolite; mouse metabolite |
cholecystokinin | [no description available] | medium | 2 | 0 | | |
diacetylfluorescein | [no description available] | medium | 5 | 0 | | |
triethyltin sulfate | [no description available] | medium | 1 | 0 | | |
trimethoprim, sulfamethoxazole drug combination | [no description available] | medium | 1 | 0 | | |
crotamiton | [no description available] | medium | 1 | 0 | | |
malathion | [no description available] | medium | 2 | 0 | diester; ethyl ester; organic thiophosphate | |
sulfamethoxazole | [no description available] | medium | 1 | 0 | isoxazoles; 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 |
1-naphthylphenylamine | [no description available] | medium | 3 | 0 | naphthalenes | |
1-naphthylamine | [no description available] | medium | 3 | 0 | naphthylamine | human xenobiotic metabolite |
rhodamine wt | [no description available] | medium | 1 | 0 | | |
f-chemotactic peptide | [no description available] | medium | 2 | 0 | | |
6-(n-(4-aminobutyl)-n-ethyl)amino-2,3-dihydrophthalazine-1,4-dione | [no description available] | medium | 1 | 0 | phthalazines | |
4-aminopropiophenone | [no description available] | medium | 1 | 0 | | |
cystamine | [no description available] | medium | 1 | 0 | organic disulfide; primary amino compound | EC 2.3.2.13 (protein-glutamine gamma-glutamyltransferase) inhibitor |
amifostine anhydrous | [no description available] | medium | 1 | 0 | diamine; organic thiophosphate | antioxidant; prodrug; radiation protective agent |
nad | [no description available] | medium | 4 | 0 | organophosphate oxoanion | cofactor; human metabolite; hydrogen acceptor; Saccharomyces cerevisiae metabolite |
isoluminol | [no description available] | medium | 1 | 0 | | |
fluvoxamine | [no description available] | medium | 1 | 0 | (trifluoromethyl)benzenes; 5-methoxyvalerophenone O-(2-aminoethyl)oxime | antidepressant; anxiolytic drug; serotonin uptake inhibitor |
citalopram | [no description available] | medium | 1 | 0 | 2-benzofurans; cyclic ether; nitrile; organofluorine compound; tertiary amino compound | |
methysergide | [no description available] | medium | 1 | 0 | ergoline alkaloid | |
ouabain | [no description available] | medium | 7 | 0 | 11alpha-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 |
potassium cyanide | [no description available] | medium | 4 | 0 | cyanide salt; one-carbon compound; potassium salt | EC 1.15.1.1 (superoxide dismutase) inhibitor; EC 1.9.3.1 (cytochrome c oxidase) inhibitor; neurotoxin |
gentamicin | [no description available] | medium | 6 | 0 | | |
dimethadione | [no description available] | medium | 1 | 0 | oxazolidinone | |
ammonium chloride | [no description available] | medium | 3 | 0 | ammonium salt; inorganic chloride | ferroptosis inhibitor |
chloroquine | [no description available] | medium | 4 | 0 | aminoquinoline; organochlorine compound; secondary amino compound; tertiary amino compound | anticoronaviral agent; antimalarial; antirheumatic drug; autophagy inhibitor; dermatologic drug |
ampicillin | [no description available] | medium | 1 | 0 | beta-lactam antibiotic; penicillin allergen; penicillin | antibacterial drug |
phenobarbital | [no description available] | medium | 1 | 0 | barbiturates | anticonvulsant; drug allergen; excitatory amino acid antagonist; sedative |
2-acetylaminofluorene | [no description available] | medium | 1 | 0 | 2-acetamidofluorenes | antimitotic; carcinogenic agent; epitope; mutagen |
diethylnitrosamine | [no description available] | medium | 1 | 0 | nitrosamine | carcinogenic agent; hepatotoxic agent; mutagen |
digitonin | [no description available] | medium | 4 | 0 | | |
nigericin | [no description available] | medium | 1 | 0 | polycyclic ether | antibacterial agent; antimicrobial agent; bacterial metabolite; potassium ionophore |
monensin | [no description available] | medium | 4 | 0 | cyclic hemiketal; monocarboxylic acid; polyether antibiotic; spiroketal | antifungal agent; coccidiostat; ionophore |
mezerein | [no description available] | medium | 1 | 0 | diterpenoid | |
dimethylformamide | [no description available] | medium | 1 | 0 | formamides; volatile organic compound | geroprotector; hepatotoxic agent; polar aprotic solvent |
iprazochrome | [no description available] | medium | 1 | 0 | | |
adrenochrome | [no description available] | medium | 1 | 0 | indoles | |
meperidine | [no description available] | medium | 1 | 0 | ethyl ester; piperidinecarboxylate ester; tertiary amino compound | antispasmodic drug; kappa-opioid receptor agonist; mu-opioid receptor agonist; opioid analgesic |
carbamazepine | [no description available] | medium | 1 | 0 | dibenzoazepine; 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 |
dactinomycin | [no description available] | medium | 2 | 0 | actinomycin | mutagen |
acetaldehyde | [no description available] | medium | 1 | 0 | aldehyde | carcinogenic 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 |
fucose | [no description available] | medium | 3 | 0 | fucopyranose; L-fucose | Escherichia coli metabolite; mouse metabolite |
deoxyuridine triphosphate | [no description available] | medium | 3 | 0 | deoxyuridine phosphate; pyrimidine 2'-deoxyribonucleoside 5'-triphosphate | Arabidopsis thaliana metabolite; Escherichia coli metabolite; human metabolite; mouse metabolite |
sodium salicylate | [no description available] | medium | 1 | 0 | organic molecular entity | |
tauro-24,25-dihydrofusidate | [no description available] | medium | 2 | 0 | | |
raffinose | [no description available] | medium | 1 | 0 | raffinose family oligosaccharide; trisaccharide | mouse metabolite; plant metabolite; Saccharomyces cerevisiae metabolite |
l 703606 | [no description available] | medium | 1 | 0 | | |
quinuclidines | [no description available] | medium | 1 | 0 | quinuclidines; saturated organic heterobicyclic parent | |
1,1'-(4,4,7,7-tetramethyl-4,7-diazaundecamethylene)bis-4-(3-methyl-2,3-dihydro(benzo-1,3-thiazole)-2-methylidene)quinolinium | [no description available] | medium | 1 | 0 | cyanine dye; organic iodide salt | fluorochrome |
sorbitol | [no description available] | medium | 1 | 0 | glucitol | cathartic; Escherichia coli metabolite; food humectant; human metabolite; laxative; metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite; sweetening agent |
sulfapyridine | [no description available] | medium | 1 | 0 | pyridines; substituted aniline; sulfonamide antibiotic; sulfonamide | antiinfective agent; dermatologic drug; drug allergen; environmental contaminant; xenobiotic |
aminooxyacetic acid | [no description available] | medium | 1 | 0 | amino 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 |
ranitidine | [no description available] | medium | 1 | 1 | C-nitro compound; furans; organic sulfide; tertiary amino compound | anti-ulcer drug; drug allergen; environmental contaminant; H2-receptor antagonist; xenobiotic |
astemizole | [no description available] | medium | 1 | 1 | benzimidazoles; piperidines | anti-allergic agent; anticoronaviral agent; H1-receptor antagonist |
eicosapentaenoic acid ethyl ester | [no description available] | medium | 1 | 0 | | |
8,11,14-eicosatrienoic acid | [no description available] | medium | 1 | 0 | fatty acid 20:3; long-chain fatty acid | fungal metabolite; human metabolite; nutraceutical |
eicosapentaenoic acid | [no description available] | medium | 1 | 0 | icosapentaenoic acid; omega-3 fatty acid | anticholesteremic drug; antidepressant; antineoplastic agent; Daphnia galeata metabolite; fungal metabolite; micronutrient; mouse metabolite; nutraceutical |
arachidonic acid | [no description available] | medium | 4 | 0 | icosa-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 |
benzoylecgonine | [no description available] | medium | 1 | 0 | benzoate ester; tropane alkaloid | epitope; human xenobiotic metabolite; marine xenobiotic metabolite; plant metabolite |
tranilast | [no description available] | medium | 1 | 0 | amidobenzoic acid; cinnamamides; dimethoxybenzene; secondary carboxamide | anti-allergic agent; anti-asthmatic drug; antineoplastic agent; aryl hydrocarbon receptor agonist; calcium channel blocker; hepatoprotective agent; nephroprotective agent |
cromolyn sodium | [no description available] | medium | 4 | 0 | organic sodium salt | anti-asthmatic drug; drug allergen |
diphenhydramine | [no description available] | medium | 2 | 0 | ether; tertiary amino compound | anti-allergic agent; antidyskinesia agent; antiemetic; antiparkinson drug; antipruritic drug; antitussive; H1-receptor antagonist; local anaesthetic; muscarinic antagonist; oneirogen; sedative |
triphenyltetrazolium | [no description available] | medium | 1 | 0 | organic cation | |
4-(dicyanomethylene)-2-methyl-6-(4-(dimethylamino)styryl)-4h-pyran | [no description available] | medium | 1 | 0 | | |
cefmenoxime | [no description available] | medium | 2 | 0 | cephalosporin | antibacterial drug |
fluorescein dilaurate | [no description available] | medium | 7 | 0 | | |
1,5-aedans | [no description available] | medium | 1 | 0 | aminonaphthalenesulfonic acid | fluorescent probe |
1,5-i-aedans | [no description available] | medium | 2 | 0 | aminonaphthalenesulfonic acid | fluorescent probe |
dansylaziridine | [no description available] | medium | 1 | 0 | | |
malonic acid | [no description available] | medium | 2 | 0 | alpha,omega-dicarboxylic acid | human metabolite |
1-butanol | [no description available] | medium | 2 | 0 | alkyl alcohol; primary alcohol; short-chain primary fatty alcohol | human metabolite; mouse metabolite; protic solvent |
technetium tc 99m pentetate | [no description available] | medium | 1 | 0 | | |
ck 17 | [no description available] | medium | 1 | 0 | | |
2'-deoxyadenosine triphosphate | [no description available] | medium | 2 | 0 | 2'-deoxyadenosine 5'-phosphate; purine 2'-deoxyribonucleoside 5'-triphosphate | Escherichia coli metabolite; mouse metabolite |
pindolol | [no description available] | medium | 1 | 0 | indoles; secondary amine | antiglaucoma drug; antihypertensive agent; beta-adrenergic antagonist; serotonergic antagonist; vasodilator agent |
phenoxybenzamine | [no description available] | medium | 2 | 0 | aromatic amine | |
sulfasalazine | [no description available] | medium | 1 | 0 | | |
calpastatin | [no description available] | medium | 1 | 0 | polypeptide | EC 3.4.22.52 (calpain-1) inhibitor; EC 3.4.22.53 (calpain-2) inhibitor |
calpain | [no description available] | medium | 1 | 0 | | |
impromidine | [no description available] | medium | 1 | 0 | | |
promethazine | [no description available] | medium | 1 | 0 | phenothiazines; tertiary amine | anti-allergic agent; anticoronaviral agent; antiemetic; antipruritic drug; H1-receptor antagonist; local anaesthetic; sedative |
eflornithine | [no description available] | medium | 2 | 0 | alpha-amino acid; fluoroamino acid | trypanocidal drug |
bromhexine | [no description available] | medium | 1 | 0 | organobromine compound; substituted aniline; tertiary amino compound | mucolytic |
albuterol | [no description available] | medium | 1 | 0 | phenols; phenylethanolamines; secondary amino compound | beta-adrenergic agonist; bronchodilator agent; environmental contaminant; xenobiotic |
azelastine | [no description available] | medium | 1 | 0 | monochlorobenzenes; phthalazines; tertiary amino compound | anti-allergic agent; anti-asthmatic drug; bronchodilator agent; EC 1.13.11.34 (arachidonate 5-lipoxygenase) inhibitor; H1-receptor antagonist; platelet aggregation inhibitor |
potassium iodide | [no description available] | medium | 1 | 0 | potassium salt | expectorant; radical scavenger |
terbutaline | [no description available] | medium | 1 | 0 | phenylethanolamines; resorcinols | anti-asthmatic drug; beta-adrenergic agonist; bronchodilator agent; EC 3.1.1.7 (acetylcholinesterase) inhibitor; hypoglycemic agent; sympathomimetic agent; tocolytic agent |
malic acid | [no description available] | medium | 3 | 0 | 2-hydroxydicarboxylic acid; C4-dicarboxylic acid | food acidity regulator; fundamental metabolite |
cadmium | [no description available] | medium | 2 | 0 | cadmium molecular entity; zinc group element atom | |
phenylpyruvic acid | [no description available] | medium | 3 | 0 | 2-oxo monocarboxylic acid | chromogenic compound; EC 6.4.1.1 (pyruvate carboxylase) inhibitor; fundamental metabolite |
methylphenazonium methosulfate | [no description available] | medium | 1 | 0 | azaheterocycle sulfate salt; phenazines | |
pyrazole | [no description available] | medium | 1 | 0 | pyrazole | |
quinolinic acid | [no description available] | medium | 1 | 0 | pyridinedicarboxylic acid | Escherichia coli metabolite; human metabolite; mouse metabolite; NMDA receptor agonist |
pyruvic acid | [no description available] | medium | 2 | 0 | 2-oxo monocarboxylic acid | cofactor; fundamental metabolite |
9-amino-6-chloro-2-methoxyacridine | [no description available] | medium | 1 | 0 | | |
glycolic acid | [no description available] | medium | 2 | 0 | 2-hydroxy monocarboxylic acid; primary alcohol | keratolytic drug; metabolite |
lacto-n-neotetraose | [no description available] | medium | 1 | 0 | | |
cc 1065 | [no description available] | medium | 1 | 0 | | |
saxitoxin | [no description available] | medium | 1 | 0 | alkaloid; carbamate ester; guanidines; ketone hydrate; paralytic shellfish toxin; pyrrolopurine | cyanotoxin; marine metabolite; neurotoxin; sodium channel blocker; toxin |
2,4-dinitrophenol | [no description available] | medium | 3 | 0 | dinitrophenol | allergen; antiseptic drug; bacterial xenobiotic metabolite; geroprotector; oxidative phosphorylation inhibitor |
1,2-dioxetane | [no description available] | medium | 2 | 0 | | |
filipin | [no description available] | medium | 2 | 0 | | |
glutamine | [no description available] | medium | 2 | 0 | amino 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 |
perfluorooctane | [no description available] | medium | 1 | 0 | fluoroalkane; fluorocarbon | |
enbucrilate | [no description available] | medium | 1 | 0 | alpha,beta-unsaturated monocarboxylic acid; nitrile | |
ethyl 2-cyanoacrylate | [no description available] | medium | 1 | 0 | | |
aminopenicillanic acid | [no description available] | medium | 1 | 0 | amino acid zwitterion; penicillanic acids | allergen |
penicillanic acid | [no description available] | medium | 1 | 0 | penicillanic acids | |
penicillin g | [no description available] | medium | 2 | 0 | penicillin allergen; penicillin | antibacterial drug; drug allergen; epitope |
c-peptide | [no description available] | medium | 2 | 1 | | |
glucagon | [no description available] | medium | 1 | 1 | peptide hormone | |
fructosamine | [no description available] | medium | 1 | 1 | | |
pentoxifylline | [no description available] | medium | 1 | 0 | oxopurine | |
indoleacetic acid | [no description available] | medium | 1 | 0 | indole-3-acetic acids; monocarboxylic acid | auxin; human metabolite; mouse metabolite; plant hormone; plant metabolite |
2-(1-hexyloxyethyl)-2-devinyl pyropheophorbide-a | [no description available] | medium | 1 | 0 | | |
chlorophyll a | [no description available] | medium | 1 | 0 | chlorophyll; methyl ester | cofactor |
stallimycin | [no description available] | medium | 1 | 0 | | |
chromomycins | [no description available] | medium | 1 | 0 | | |
cyanuric chloride | [no description available] | medium | 1 | 0 | chloro-1,3,5-triazine; organochlorine compound | cross-linking reagent |
suprofen | [no description available] | medium | 2 | 0 | aromatic 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 |
tolmetin | [no description available] | medium | 1 | 0 | aromatic ketone; monocarboxylic acid; pyrroles | EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor; non-steroidal anti-inflammatory drug |
cadmium chloride | [no description available] | medium | 1 | 0 | cadmium coordination entity | |
dipivefrin | [no description available] | medium | 1 | 0 | ethanolamines; pivalate ester | adrenergic agonist; antiglaucoma drug; ophthalmology drug; prodrug; sympathomimetic agent |
monochlorobimane | [no description available] | medium | 1 | 0 | organochlorine compound; pyrazolopyrazole | fluorochrome |
cytochalasin b | [no description available] | medium | 3 | 0 | cytochalasin; lactam; lactone; organic heterotricyclic compound | actin polymerisation inhibitor; metabolite; mycotoxin; platelet aggregation inhibitor |
cetirizine | [no description available] | medium | 1 | 1 | ether; monocarboxylic acid; monochlorobenzenes; piperazines | anti-allergic agent; environmental contaminant; H1-receptor antagonist; xenobiotic |
tetrandrine | [no description available] | medium | 1 | 0 | bisbenzylisoquinoline alkaloid; isoquinolines | |
phenanthrene | [no description available] | medium | 1 | 0 | ortho-fused polycyclic arene; ortho-fused tricyclic hydrocarbon; phenanthrenes | environmental contaminant; mouse metabolite |
diazomethane | [no description available] | medium | 1 | 0 | diazo compound | alkylating agent; antineoplastic agent; carcinogenic agent; poison |
biocytin | [no description available] | medium | 1 | 0 | azabicycloalkane; L-alpha-amino acid zwitterion; L-lysine derivative; monocarboxylic acid amide; non-proteinogenic L-alpha-amino acid; thiabicycloalkane; ureas | mouse metabolite |
dinoprost | [no description available] | medium | 3 | 0 | monocarboxylic acid; prostaglandins Falpha | human metabolite; mouse metabolite |
prostaglandin f2 isopropyl ester | [no description available] | medium | 1 | 0 | prostanoid | |
carbamates | [no description available] | medium | 2 | 0 | amino-acid anion | |
atrial natriuretic factor | [no description available] | medium | 1 | 0 | polypeptide | |
natriuretic peptide, brain | [no description available] | medium | 1 | 0 | polypeptide | |
methionine | [no description available] | medium | 2 | 0 | aspartate family amino acid; L-alpha-amino acid; methionine zwitterion; methionine; proteinogenic amino acid | antidote to paracetamol poisoning; human metabolite; micronutrient; mouse metabolite; nutraceutical |
naphthalan | [no description available] | medium | 1 | 0 | | |
acetazolamide | [no description available] | medium | 6 | 4 | monocarboxylic acid amide; sulfonamide; thiadiazoles | anticonvulsant; diuretic; EC 4.2.1.1 (carbonic anhydrase) inhibitor |
1,3-dimethylthiourea | [no description available] | medium | 1 | 0 | | |
fomepizole | [no description available] | medium | 1 | 0 | pyrazoles | antidote; EC 1.1.1.1 (alcohol dehydrogenase) inhibitor; protective agent |
beta-naltrexamine | [no description available] | medium | 1 | 0 | | |
3-(5'-hydroxymethyl-2'-furyl)-1-benzylindazole | [no description available] | medium | 1 | 0 | aromatic primary alcohol; furans; indazoles | antineoplastic agent; apoptosis inducer; platelet aggregation inhibitor; soluble guanylate cyclase activator; vasodilator agent |
cathepsin g | [no description available] | medium | 1 | 0 | | |
organophosphonates | [no description available] | medium | 2 | 0 | divalent inorganic anion; phosphite ion | |
bendazac lysine | [no description available] | medium | 1 | 1 | | |
iodonaphthylazide | [no description available] | medium | 1 | 0 | | |
5-((4,6-dichloro-1,3,5-triazin-2-yl)amino)fluorescein | [no description available] | medium | 1 | 0 | | |
gallium | [no description available] | medium | 2 | 0 | boron group element atom | |
cyclonite | [no description available] | medium | 1 | 0 | 1,3,5-triazinanes; N-nitro compound | explosive |
keratan sulfate | [no description available] | medium | 1 | 0 | | |
rolitetracycline | [no description available] | medium | 1 | 0 | | |
xenon radioisotopes | [no description available] | medium | 1 | 0 | | |
6-aminoquinolyl-n-hydroxysuccinimidyl carbamate | [no description available] | medium | 1 | 0 | | |
neuropeptide y | [no description available] | medium | 3 | 0 | | |
pyrimidine dimers | [no description available] | medium | 1 | 0 | | |
chromomycin a3 | [no description available] | medium | 1 | 0 | | |
5'-s-(2-aminoethyl)-n(6)-(4-nitrobenzyl)-5'-thioadenosine | [no description available] | medium | 1 | 0 | | |
ethoxyresorufin | [no description available] | medium | 1 | 0 | phenoxazine | |
phytic acid | [no description available] | medium | 1 | 0 | inositol phosphate | |
maleic acid | [no description available] | medium | 1 | 0 | butenedioic acid | algal metabolite; mouse metabolite; plant metabolite |
5-methyldeoxycytidine triphosphate | [no description available] | medium | 1 | 0 | 2'-deoxycytidine phosphate; pyrimidine 2'-deoxyribonucleoside 5'-triphosphate | |
deoxyguanosine | [no description available] | medium | 2 | 0 | purine 2'-deoxyribonucleoside; purines 2'-deoxy-D-ribonucleoside | Escherichia coli metabolite; human metabolite; mouse metabolite; Saccharomyces cerevisiae metabolite |
bromphenol blue | [no description available] | medium | 1 | 0 | 2,1-benzoxathiole; arenesulfonate ester; organobromine compound; phenols; sultone | acid-base indicator; dye; two-colour indicator |
titan yellow | [no description available] | medium | 1 | 0 | | |
u 74006f | [no description available] | medium | 1 | 0 | corticosteroid hormone | |
glutaral | [no description available] | medium | 4 | 0 | dialdehyde | cross-linking reagent; disinfectant; fixative |
gluma | [no description available] | medium | 1 | 0 | | |
procion green h-e4bd | [no description available] | medium | 1 | 0 | | |
3,3'-diaminobenzidine | [no description available] | medium | 3 | 0 | biphenyls; substituted aniline | histological dye |
rh 421 | [no description available] | medium | 1 | 0 | | |
maclurin | [no description available] | medium | 2 | 0 | benzophenones | |
azoxymethane | [no description available] | medium | 2 | 0 | | |
pentamidine | [no description available] | medium | 1 | 0 | aromatic 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 |
tytin | [no description available] | medium | 1 | 0 | | |
casein kinase ii | [no description available] | medium | 1 | 0 | | |
s-nitrosopenicillamine | [no description available] | medium | 1 | 0 | | |
melphalan | [no description available] | medium | 1 | 0 | L-phenylalanine derivative; nitrogen mustard; non-proteinogenic L-alpha-amino acid; organochlorine compound | alkylating agent; antineoplastic agent; carcinogenic agent; drug allergen; immunosuppressive agent |
argon | [no description available] | medium | 2 | 0 | monoatomic argon; noble gas atom; p-block element atom | food packaging gas; neuroprotective agent |
porphobilinogen | [no description available] | medium | 1 | 0 | aralkylamino compound; dicarboxylic acid; pyrroles | Escherichia coli metabolite; metabolite; mouse metabolite |
lewis x antigen | [no description available] | medium | 1 | 0 | | |
inositol | [no description available] | medium | 1 | 0 | cyclitol; hexol | |
enkephalin, methionine | [no description available] | medium | 1 | 0 | | |
trypsinogen | [no description available] | medium | 1 | 0 | | |
potassium hydroxide | [no description available] | medium | 1 | 0 | alkali metal hydroxide | |
nitrogenase | [no description available] | medium | 2 | 0 | | |
biotinyltyramide | [no description available] | medium | 1 | 0 | | |
chlorfenvinphos | [no description available] | medium | 1 | 0 | dichlorobenzene; organic phosphate; organochlorine acaricide; organochlorine insecticide; organophosphate insecticide | agrochemical; EC 3.1.1.7 (acetylcholinesterase) inhibitor; EC 3.1.1.8 (cholinesterase) inhibitor |
dimethoate | [no description available] | medium | 1 | 0 | monocarboxylic acid amide; organic thiophosphate | acaricide; agrochemical; EC 3.1.1.7 (acetylcholinesterase) inhibitor; EC 3.1.1.8 (cholinesterase) inhibitor; environmental contaminant; insecticide; xenobiotic |
rolipram | [no description available] | medium | 1 | 0 | pyrrolidin-2-ones | antidepressant; EC 3.1.4.* (phosphoric diester hydrolase) inhibitor |
iodoantipyrine | [no description available] | medium | 1 | 0 | | |
thionine | [no description available] | medium | 1 | 0 | | |
calcitonin | [no description available] | medium | 1 | 0 | | |
nonoxynol | [no description available] | medium | 1 | 0 | | |
ganciclovir | [no description available] | medium | 1 | 0 | 2-aminopurines; oxopurine | antiinfective agent; antiviral drug |
estriol | [no description available] | medium | 1 | 0 | 16alpha-hydroxy steroid; 17beta-hydroxy steroid; 3-hydroxy steroid | estrogen; human metabolite; human xenobiotic metabolite; mouse metabolite |
oxazolone | [no description available] | medium | 3 | 0 | | |
sybr green ii | [no description available] | medium | 1 | 0 | | |
n-succinyl-chitosan | [no description available] | medium | 1 | 0 | | |
methylprednisolone hemisuccinate | [no description available] | medium | 1 | 1 | corticosteroid hormone; hemisuccinate | |
benzoporphyrin d | [no description available] | medium | 1 | 0 | | |
manganese | [no description available] | medium | 1 | 0 | elemental manganese; manganese group element atom | Escherichia coli metabolite; micronutrient |
rutin | [no description available] | medium | 1 | 0 | disaccharide derivative; quercetin O-glucoside; rutinoside; tetrahydroxyflavone | antioxidant; metabolite |
cardiovascular agents | [no description available] | medium | 1 | 0 | | |
1,4-dioxane | [no description available] | medium | 1 | 0 | dioxane; volatile organic compound | carcinogenic agent; metabolite; NMR chemical shift reference compound; non-polar solvent |
theobromine | [no description available] | medium | 2 | 0 | dimethylxanthine | adenosine receptor antagonist; bronchodilator agent; food component; human blood serum metabolite; mouse metabolite; plant metabolite; vasodilator agent |
fluo-3 | [no description available] | medium | 1 | 0 | xanthene dye | fluorochrome |
2-(2-(5-carboxy)oxazole)-5-hydroxy-6-aminobenzofuran-n,n,o-triacetic acid | [no description available] | medium | 1 | 0 | | |
2-phenyloxazolone | [no description available] | medium | 1 | 0 | 1,3-oxazoles | |
4-(2-aminoethyl)benzenesulfonylfluoride | [no description available] | medium | 1 | 0 | | |
glycocholic acid | [no description available] | medium | 3 | 0 | bile acid glycine conjugate | human metabolite |
florfenicol | [no description available] | medium | 1 | 1 | organochlorine compound; organofluorine compound; secondary alcohol; secondary carboxamide; sulfone | antimicrobial agent |
thiamphenicol | [no description available] | medium | 1 | 1 | monocarboxylic acid amide; sulfone | antimicrobial agent; immunosuppressive agent |
beta-endorphin | [no description available] | medium | 1 | 0 | | |
calcium oxalate | [no description available] | medium | 1 | 0 | organic calcium salt | |
acetaminophen | [no description available] | medium | 1 | 0 | acetamides; 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 |
zidovudine | [no description available] | medium | 1 | 0 | azide; pyrimidine 2',3'-dideoxyribonucleoside | antimetabolite; antiviral drug; HIV-1 reverse transcriptase inhibitor |
loperamide | [no description available] | medium | 1 | 0 | monocarboxylic acid amide; monochlorobenzenes; piperidines; tertiary alcohol | anticoronaviral agent; antidiarrhoeal drug; mu-opioid receptor agonist |
brinzolamide | [no description available] | medium | 1 | 1 | sulfonamide; thienothiazine | antiglaucoma drug; EC 4.2.1.1 (carbonic anhydrase) inhibitor |
s-(2-chloro-1,1,2-trifluoroethyl)cysteine | [no description available] | medium | 1 | 0 | | |
idoxuridine | [no description available] | medium | 1 | 0 | organoiodine compound; pyrimidine 2'-deoxyribonucleoside | antiviral drug; DNA synthesis inhibitor |
enalapril | [no description available] | medium | 1 | 1 | dicarboxylic acid monoester; dipeptide | antihypertensive agent; EC 3.4.15.1 (peptidyl-dipeptidase A) inhibitor; geroprotector; prodrug |
acetic anhydride | [no description available] | medium | 1 | 0 | acyclic carboxylic anhydride | metabolite; reagent |
2,3-diaminonaphthalene | [no description available] | medium | 1 | 0 | | |
2-naphthylamine | [no description available] | medium | 1 | 0 | naphthylamine | carcinogenic agent |
oleanolic acid | [no description available] | medium | 1 | 0 | hydroxy monocarboxylic acid; pentacyclic triterpenoid | plant metabolite |
s 0139 | [no description available] | medium | 1 | 0 | | |
diphenylguanidine | [no description available] | medium | 1 | 0 | guanidines | allergen |
diphenylthiourea | [no description available] | medium | 1 | 0 | thioureas | allergen |
kemptide | [no description available] | medium | 1 | 0 | | |
thiophosphoric acid | [no description available] | medium | 1 | 0 | phosphorothioic acid | |
tesmilifene | [no description available] | medium | 1 | 0 | diarylmethane | |
thioguanine anhydrous | [no description available] | medium | 1 | 0 | 2-aminopurines | anticoronaviral agent; antimetabolite; antineoplastic agent |
2-phenylsuccinate | [no description available] | medium | 1 | 0 | | |
lutetium | [no description available] | medium | 1 | 0 | d-block element atom; lanthanoid atom | |
motexafin lutetium | [no description available] | medium | 1 | 0 | | |
motexafin gadolinium | [no description available] | medium | 1 | 0 | | |
betaxolol | [no description available] | medium | 1 | 1 | propanolamine | antihypertensive agent; beta-adrenergic antagonist; sympatholytic agent |
carvedilol | [no description available] | medium | 1 | 0 | carbazoles; secondary alcohol; secondary amino compound | alpha-adrenergic antagonist; antihypertensive agent; beta-adrenergic antagonist; cardiovascular drug; vasodilator agent |
noc-5 | [no description available] | medium | 1 | 0 | | |
naphthalene | [no description available] | medium | 1 | 0 | naphthalenes; ortho-fused bicyclic arene | apoptosis inhibitor; carcinogenic agent; environmental contaminant; mouse metabolite; plant metabolite; volatile oil component |
phosphoserine | [no description available] | medium | 1 | 0 | non-proteinogenic alpha-amino acid; O-phosphoamino acid; serine derivative | human metabolite |
latrunculin a | [no description available] | medium | 1 | 0 | cyclic hemiketal; macrolide; oxabicycloalkane; thiazolidinone | actin polymerisation inhibitor; metabolite; toxin |
latrunculin b | [no description available] | medium | 1 | 0 | cyclic hemiketal; macrolide; oxabicycloalkane; thiazolidinone | actin polymerisation inhibitor; metabolite; toxin |
morphine-6-glucuronide | [no description available] | medium | 1 | 0 | morphinane alkaloid | |
codeine | [no description available] | medium | 1 | 0 | morphinane alkaloid; organic heteropentacyclic compound | antitussive; drug allergen; environmental contaminant; opioid analgesic; opioid receptor agonist; prodrug; xenobiotic |
oxycodone | [no description available] | medium | 1 | 0 | organic heteropentacyclic compound; semisynthetic derivative | antitussive; mu-opioid receptor agonist; opioid analgesic |
lanthiopeptin | [no description available] | medium | 1 | 0 | heterodetic cyclic peptide; L-cysteine thioether; macrocycle; type B lantibiotic | |
ethanolamine | [no description available] | medium | 3 | 0 | ethanolamines; primary alcohol; primary amine | Escherichia coli metabolite; human metabolite; mouse metabolite |
4-methylumbelliferyl phosphate | [no description available] | medium | 1 | 0 | | |
hymecromone | [no description available] | medium | 2 | 0 | hydroxycoumarin | antineoplastic agent; hyaluronic acid synthesis inhibitor |
5-cyano-2,3-ditolyltetrazolium chloride | [no description available] | medium | 1 | 0 | | |
rutecarpine | [no description available] | medium | 1 | 0 | beta-carbolines | |
quinazolines | [no description available] | medium | 3 | 0 | azaarene; mancude organic heterobicyclic parent; ortho-fused heteroarene; quinazolines | |
ml 7 | [no description available] | medium | 1 | 0 | N-sulfonyldiazepane; organoiodine compound | EC 2.7.11.18 (myosin-light-chain kinase) inhibitor |
alpha-amino-3-hydroxy-5-methyl-4-isoxazolepropionic acid | [no description available] | medium | 1 | 0 | non-proteinogenic alpha-amino acid | |
pirenoxine | [no description available] | medium | 1 | 0 | organic molecular entity | |
pyrithione | [no description available] | medium | 1 | 0 | monohydroxypyridine; pyridinethione | ionophore |
peridinin | [no description available] | medium | 1 | 0 | | |
7-aminoactinomycin d | [no description available] | medium | 1 | 0 | | |
angiotensin ii, des-asp(1)-des-arg(2)-ile(5)- | [no description available] | medium | 1 | 0 | organic molecular entity | |
fumonisin b1 | [no description available] | medium | 1 | 0 | diester; fumonisin; primary amino compound; triol | carcinogenic agent; metabolite |
ethyl oleate | [no description available] | medium | 1 | 0 | long-chain fatty acid ethyl ester | acaricide; plant metabolite |
oleylamine | [no description available] | medium | 1 | 0 | | |
deferiprone | [no description available] | medium | 1 | 0 | 4-pyridones | iron chelator; protective agent |
methylnitrosourea | [no description available] | medium | 1 | 0 | N-nitrosoureas | alkylating agent; carcinogenic agent; mutagen; teratogenic agent |
perylene | [no description available] | medium | 1 | 0 | ortho- and peri-fused polycyclic arene; perylenes | |
hypericin | [no description available] | medium | 1 | 0 | | |
hydroxypropylmethylcellulose acetate succinate | [no description available] | medium | 1 | 0 | | |
uridine | [no description available] | medium | 1 | 0 | uridines | drug metabolite; fundamental metabolite; human metabolite |
4-iodoacetamidosalicylic acid | [no description available] | medium | 1 | 0 | | |
5-iodoacetamidofluorescein | [no description available] | medium | 1 | 0 | | |
oxadiazoles | [no description available] | medium | 1 | 0 | | |
4-(n-(iodoacetoxy)ethyl-n-methyl)amino-7-nitrobenz-2-oxa-1,3-diazole | [no description available] | medium | 1 | 0 | | |
8-azidoethidium | [no description available] | medium | 1 | 0 | | |
hematoxylin | [no description available] | medium | 2 | 0 | organic heterotetracyclic compound; oxacycle; polyphenol; tertiary alcohol | histological dye; plant metabolite |
tyrosine | [no description available] | medium | 1 | 0 | alpha-amino-acid radical | |
penicillamine | [no description available] | medium | 2 | 0 | non-proteinogenic alpha-amino acid; penicillamine | antirheumatic drug; chelator; copper chelator; drug allergen |
s-nitro-n-acetylpenicillamine | [no description available] | medium | 2 | 0 | | |
n-(((4-benzoylamino)phenyl)sulfonyl)glycine | [no description available] | medium | 1 | 0 | | |
enkephalin, ala(2)-mephe(4)-gly(5)- | [no description available] | medium | 1 | 0 | | |
ellagic acid | [no description available] | medium | 1 | 0 | catechols; cyclic ketone; lactone; organic heterotetracyclic compound; polyphenol | antioxidant; EC 1.14.18.1 (tyrosinase) inhibitor; EC 2.3.1.5 (arylamine N-acetyltransferase) inhibitor; EC 2.4.1.1 (glycogen phosphorylase) inhibitor; EC 2.5.1.18 (glutathione transferase) inhibitor; EC 2.7.1.127 (inositol-trisphosphate 3-kinase) inhibitor; EC 2.7.1.151 (inositol-polyphosphate multikinase) inhibitor; EC 2.7.4.6 (nucleoside-diphosphate kinase) inhibitor; EC 2.7.7.7 (DNA-directed DNA polymerase) inhibitor; EC 5.99.1.2 (DNA topoisomerase) inhibitor; EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor; food additive; fungal metabolite; geroprotector; plant metabolite; skin lightening agent |
phosphorodithioic acid | [no description available] | medium | 1 | 0 | phosphorothioic acid | |
bafilomycin a | [no description available] | medium | 1 | 0 | | |
1,2-bis(2-aminophenoxy)ethane-n,n,n',n'-tetraacetic acid | [no description available] | medium | 1 | 0 | polyamino carboxylic acid; tetracarboxylic acid | chelator |
noc 9 | [no description available] | medium | 1 | 0 | | |
thiazole orange | [no description available] | medium | 1 | 0 | cyanine dye | fluorochrome |
desciclovir | [no description available] | medium | 1 | 0 | | |
clonidine | [no description available] | medium | 4 | 3 | clonidine; imidazoline | |
tosylphenylalanyl chloromethyl ketone | [no description available] | medium | 1 | 0 | alpha-chloroketone; sulfonamide | alkylating agent; serine proteinase inhibitor |
tosyllysine chloromethyl ketone | [no description available] | medium | 1 | 0 | sulfonic acid derivative | |
benzyloxycarbonylvalyl-alanyl-aspartyl fluoromethyl ketone | [no description available] | medium | 1 | 0 | | |
oregon green 514 | [no description available] | medium | 1 | 0 | xanthene dye | fluorochrome |
diuron | [no description available] | medium | 1 | 0 | 3-(3,4-substituted-phenyl)-1,1-dimethylurea; dichlorobenzene | environmental contaminant; mitochondrial respiratory-chain inhibitor; photosystem-II inhibitor; urea herbicide; xenobiotic |
sodium nitrite | [no description available] | medium | 1 | 0 | inorganic sodium salt; nitrite salt | antidote to cyanide poisoning; antihypertensive agent; antimicrobial food preservative; food antioxidant; poison |
cycloheximide | [no description available] | medium | 1 | 0 | antibiotic fungicide; cyclic ketone; dicarboximide; piperidine antibiotic; piperidones; secondary alcohol | anticoronaviral agent; bacterial metabolite; ferroptosis inhibitor; neuroprotective agent; protein synthesis inhibitor |
sincalide | [no description available] | medium | 1 | 0 | oligopeptide | |
1-palmitoyl-2-(6-(n-(7-nitrobenz)-2-oxa-1,3-diazol-4-yl)aminocaproyl)phosphatidylcholine | [no description available] | medium | 1 | 0 | 1,2-diacyl-sn-glycero-3-phosphocholine(1+) | fluorescent probe |
dihydrotetramethylrosamine | [no description available] | medium | 1 | 0 | | |
2,2,5,7,8-pentamethyl-1-hydroxychroman | [no description available] | medium | 1 | 0 | | |
propargylamine | [no description available] | medium | 1 | 0 | | |
pargyline | [no description available] | medium | 1 | 0 | aromatic amine | |
propynyloxy-2'-deoxyuridine | [no description available] | medium | 1 | 0 | | |
sorbic acid | [no description available] | medium | 1 | 0 | alpha,beta-unsaturated monocarboxylic acid; sorbic acid | |
1,3-dibromo-5,5-dimethylhydantoin | [no description available] | medium | 1 | 0 | | |
flucytosine | [no description available] | medium | 1 | 0 | aminopyrimidine; nucleoside analogue; organofluorine compound; pyrimidine antifungal drug; pyrimidone | prodrug |
cinnarizine | [no description available] | medium | 1 | 0 | diarylmethane; N-alkylpiperazine; olefinic compound | anti-allergic agent; antiemetic; calcium channel blocker; geroprotector; H1-receptor antagonist; histamine antagonist; muscarinic antagonist |
hydantoins | [no description available] | medium | 1 | 0 | imidazolidine-2,4-dione | |
7-benzyloxy-4-trifluoromethylcoumarin | [no description available] | medium | 1 | 0 | | |
phosphorodiamidic acid | [no description available] | medium | 1 | 0 | | |
unithiol | [no description available] | medium | 1 | 0 | | |
deuterium | [no description available] | medium | 2 | 0 | dihydrogen | |
2,2,6,6-tetramethylpiperidine-n-oxide-4-amino-4-carboxylic acid | [no description available] | medium | 1 | 0 | aminoxyls; piperidinemonocarboxylic acid | |
rubidium | [no description available] | medium | 2 | 0 | alkali metal atom | |
oligomycins | [no description available] | medium | 1 | 0 | | |
mannans | [no description available] | medium | 1 | 0 | | |
hirugen | [no description available] | medium | 1 | 0 | | |
moxalactam | [no description available] | medium | 1 | 0 | cephalosporin; oxacephem | antibacterial drug |
cefotetan | [no description available] | medium | 1 | 0 | | |
cefoxitin | [no description available] | medium | 1 | 0 | beta-lactam antibiotic allergen; cephalosporin; cephamycin; semisynthetic derivative | antibacterial drug |
1-n-methyl-5-thiotetrazole | [no description available] | medium | 1 | 0 | | |
perflutren | [no description available] | medium | 2 | 0 | fluoroalkane; fluorocarbon | |
7-amino-4-methylcoumarin-3-acetate | [no description available] | medium | 3 | 0 | | |
9-hydroxyphenylfluoron | [no description available] | medium | 2 | 0 | | |
pyrenedecanoic acid | [no description available] | medium | 1 | 0 | | |
poloxalene | [no description available] | medium | 1 | 0 | epoxide | |
lithium chloride | [no description available] | medium | 1 | 0 | inorganic chloride; lithium salt | antimanic drug; geroprotector |
glutaric acid | [no description available] | medium | 1 | 0 | alpha,omega-dicarboxylic acid; dicarboxylic fatty acid | Daphnia magna metabolite; human metabolite |
apraclonidine | [no description available] | medium | 2 | 2 | dichlorobenzene; guanidines; imidazolines | alpha-adrenergic agonist; antiglaucoma drug; beta-adrenergic agonist; diagnostic agent; ophthalmology drug |
eledoisin | [no description available] | medium | 1 | 0 | peptide | |
piroxicam | [no description available] | medium | 1 | 0 | benzothiazine; monocarboxylic acid amide; pyridines | analgesic; antirheumatic drug; cyclooxygenase 1 inhibitor; EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor; non-steroidal anti-inflammatory drug |
azinphosmethyl | [no description available] | medium | 1 | 0 | benzotriazines; organic thiophosphate; organothiophosphate insecticide | agrochemical; EC 3.1.1.7 (acetylcholinesterase) inhibitor; EC 3.1.1.8 (cholinesterase) inhibitor |
4-nitroquinoline-1-oxide | [no description available] | medium | 1 | 0 | C-nitro compound; quinoline N-oxide | carcinogenic agent |
flutropium bromide | [no description available] | medium | 1 | 0 | | |
ketotifen | [no description available] | medium | 1 | 0 | cyclic ketone; olefinic compound; organic heterotricyclic compound; organosulfur heterocyclic compound; piperidines; tertiary amino compound | anti-asthmatic drug; H1-receptor antagonist |
alpha-phenylcinnamate | [no description available] | medium | 1 | 0 | | |
normetanephrine | [no description available] | medium | 1 | 0 | catecholamine | |
sulpiride | [no description available] | medium | 1 | 0 | benzamides; N-alkylpyrrolidine; sulfonamide | antidepressant; antiemetic; antipsychotic agent; dopaminergic antagonist |
epsilon-dinitrophenyllysine | [no description available] | medium | 1 | 0 | N(6)-(2,4-dinitrophenyl)lysine | |
hematoporphyrin | [no description available] | medium | 1 | 0 | | |
nitroblue tetrazolium | [no description available] | medium | 1 | 0 | organic cation | |
lauric acid | [no description available] | medium | 1 | 0 | medium-chain fatty acid; straight-chain saturated fatty acid | algal metabolite; antibacterial agent; plant metabolite |
nortriptyline | [no description available] | medium | 1 | 0 | organic tricyclic compound; secondary amine | adrenergic uptake inhibitor; analgesic; antidepressant; antineoplastic agent; apoptosis inducer; drug metabolite |
10-hydroxynortriptyline | [no description available] | medium | 1 | 0 | | |
rubidium chloride | [no description available] | medium | 1 | 0 | inorganic chloride; rubidium molecular entity | antidepressant; biomarker |
tin | [no description available] | medium | 1 | 0 | carbon group element atom; elemental tin; metal atom | micronutrient |
pituitrin | [no description available] | medium | 1 | 0 | | |
arginine vasopressin | [no description available] | medium | 1 | 0 | vasopressin | cardiovascular drug; hematologic agent; mitogen |
neon | [no description available] | medium | 1 | 0 | monoatomic neon; noble gas atom; p-block element atom | |
hexylene glycol | [no description available] | medium | 2 | 0 | glycol | |
trimetrexate | [no description available] | medium | 2 | 0 | | |
piritrexim | [no description available] | medium | 1 | 0 | | |
arotinolol | [no description available] | medium | 1 | 1 | aromatic amide; thiophenes | |
carteolol | [no description available] | medium | 1 | 1 | quinolone; secondary alcohol | anti-arrhythmia drug; antiglaucoma drug; antihypertensive agent; beta-adrenergic antagonist; sympatholytic agent |
c.i. fluorescent brightening agent 28 | [no description available] | medium | 1 | 0 | | |
bendroflumethiazide | [no description available] | medium | 1 | 0 | benzothiadiazine; sulfonamide | antihypertensive agent; diuretic |
dipyridamole | [no description available] | medium | 1 | 0 | piperidines; pyrimidopyrimidine; tertiary amino compound; tetrol | adenosine phosphodiesterase inhibitor; EC 3.5.4.4 (adenosine deaminase) inhibitor; platelet aggregation inhibitor; vasodilator agent |
pentazocine | [no description available] | medium | 1 | 0 | benzazocine | |
buprenorphine | [no description available] | medium | 1 | 0 | morphinane alkaloid | delta-opioid receptor antagonist; kappa-opioid receptor antagonist; mu-opioid receptor agonist; opioid analgesic |
n-formylmethionylphenylalanine | [no description available] | medium | 1 | 0 | peptide | |
n-formylnorleucyl-leucyl-4-phenylalanine | [no description available] | medium | 1 | 0 | | |
octamethylenediamine | [no description available] | medium | 1 | 0 | alkane-alpha,omega-diamine | |
nimodipine | [no description available] | medium | 1 | 0 | 2-methoxyethyl ester; C-nitro compound; dicarboxylic acids and O-substituted derivatives; diester; dihydropyridine; isopropyl ester | antihypertensive agent; calcium channel blocker; cardiovascular drug; vasodilator agent |
sulindac | [no description available] | medium | 1 | 1 | monocarboxylic 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 |
anthroylouabain | [no description available] | medium | 1 | 0 | | |
merocyanine dye | [no description available] | medium | 1 | 0 | | |
pyrimidinones | [no description available] | medium | 1 | 0 | | |
valinomycin | [no description available] | medium | 1 | 0 | cyclodepsipeptide; macrocycle | antimicrobial agent; antiviral agent; bacterial metabolite; potassium ionophore |
acridine yellow | [no description available] | medium | 1 | 0 | aminoacridines; hydrochloride | fluorochrome |
1-oleoyl-2-acetylglycerol | [no description available] | medium | 1 | 0 | 1,2-diglyceride | |
pyoverdin | [no description available] | medium | 1 | 0 | | |
sodium iodate | [no description available] | medium | 2 | 0 | organic molecular entity | |
galactose | [no description available] | medium | 1 | 0 | | |
bentiromide | [no description available] | medium | 2 | 0 | dipeptide | diagnostic agent; indicator; reagent |
4-methylumbelliferyl heptanoate | [no description available] | medium | 1 | 0 | | |
diatrizoate meglumine | [no description available] | medium | 1 | 0 | monocarboxylic acid anion | radioopaque medium |
urografin 76 | [no description available] | medium | 1 | 0 | | |
diatrizoic acid | [no description available] | medium | 1 | 0 | acetamides; benzoic acids; organoiodine compound | environmental contaminant; radioopaque medium; xenobiotic |
nitrohydroxyiodophenylacetate | [no description available] | medium | 1 | 0 | 2-nitrophenols; organoiodine compound; phenylacetic acids | antigen |
sorbinil | [no description available] | medium | 1 | 0 | azaspiro compound; chromanes; imidazolidinone; organofluorine compound; oxaspiro compound | antioxidant; EC 1.1.1.21 (aldehyde reductase) inhibitor |
sorbinil | [no description available] | medium | 1 | 1 | azaspiro compound; chromanes; imidazolidinone; organofluorine compound; oxaspiro compound | antioxidant; EC 1.1.1.21 (aldehyde reductase) inhibitor |
imidazolidines | [no description available] | medium | 1 | 1 | azacycloalkane; imidazolidines; saturated organic heteromonocyclic parent | |
amphetamine | [no description available] | medium | 1 | 0 | primary amine | |
dextroamphetamine | [no description available] | medium | 1 | 0 | 1-phenylpropan-2-amine | adrenergic agent; adrenergic uptake inhibitor; dopamine uptake inhibitor; dopaminergic agent; neurotoxin; sympathomimetic agent |
acetylglucosamine | [no description available] | medium | 1 | 0 | N-acetyl-D-glucosamine | epitope |
acetylgalactosamine | [no description available] | medium | 1 | 0 | N-acetyl-D-hexosamine; N-acetylgalactosamine | Escherichia coli metabolite; human metabolite; mouse metabolite |
5,5'-bis(8-(phenylamino)-1-naphthalenesulfonate) | [no description available] | medium | 1 | 0 | | |
dodecyl sulfate | [no description available] | medium | 1 | 0 | alkyl sulfate | |
ceruletide | [no description available] | medium | 1 | 0 | oligopeptide | diagnostic agent; gastrointestinal drug |
4-acetamido-4'-isothiocyanatostilbene-2,2'-disulfonic acid | [no description available] | medium | 1 | 0 | stilbenoid | |
2-keto-4-methylvalerate | [no description available] | medium | 1 | 0 | 2-oxo monocarboxylic acid; branched-chain keto acid | algal metabolite; human metabolite |
thioflavin t | [no description available] | medium | 1 | 0 | organic chloride salt | fluorochrome; geroprotector; histological dye |
4-methylhistamine | [no description available] | medium | 1 | 0 | aralkylamino compound; imidazoles | histamine agonist; metabolite |
pyrilamine | [no description available] | medium | 1 | 0 | aromatic ether; ethylenediamine derivative | H1-receptor antagonist |
metiamide | [no description available] | medium | 1 | 0 | imidazoles | |
glucuronyl glucosamine glycan sulfate | [no description available] | medium | 2 | 0 | | |
phenylephrine hydrochloride | [no description available] | medium | 6 | 0 | hydrochloride | |
eye | [no description available] | medium | 84 | 12 | | |
isomethyleugenol | [no description available] | medium | 6 | 0 | isomethyleugenol | |
oxybutynin | [no description available] | medium | 1 | 0 | acetylenic compound; carboxylic ester; racemate; tertiary alcohol; tertiary amino compound | antispasmodic drug; calcium channel blocker; local anaesthetic; muscarinic antagonist; muscle relaxant; parasympatholytic |
guaifenesin | [no description available] | medium | 10 | 0 | methoxybenzenes | |
fenoxycarb | [no description available] | medium | 3 | 0 | aromatic ether; carbamate ester | environmental contaminant; insecticide; juvenile hormone mimic; xenobiotic |
trazodone hydrochloride | [no description available] | medium | 6 | 0 | hydrochloride | adrenergic antagonist; antidepressant; H1-receptor antagonist; sedative; serotonin uptake inhibitor |
methyl salicylate | [no description available] | medium | 2 | 0 | benzoate ester; methyl ester; salicylates | flavouring agent; insect attractant; metabolite |
fomesafen | [no description available] | medium | 3 | 0 | aromatic ether; C-nitro compound; monochlorobenzenes; N-sulfonylcarboxamide; organofluorine compound; phenols | agrochemical; EC 1.3.3.4 (protoporphyrinogen oxidase) inhibitor; herbicide |
propiconazole | [no description available] | medium | 5 | 0 | conazole fungicide; cyclic ketal; dichlorobenzene; triazole fungicide; triazoles | antifungal agrochemical; EC 1.14.13.70 (sterol 14alpha-demethylase) inhibitor; environmental contaminant; xenobiotic |
iodinated glycerol | [no description available] | medium | 1 | 0 | dioxolane | |
torpedo | [no description available] | medium | 3 | 0 | | |
exudates | [no description available] | medium | 1 | 0 | | |
fusarium | [no description available] | medium | 2 | 0 | | |
isoniazid | [no description available] | medium | 1 | 0 | carbohydrazide | antitubercular agent; drug allergen |
bassianolide | [no description available] | medium | 1 | 0 | cyclodepsipeptide; cyclooctadepsipeptide | antineoplastic agent; fungal metabolite; insecticide |
nociceptin | [no description available] | medium | 1 | 0 | organic molecular entity; polypeptide | human metabolite; rat metabolite |
egg white | [no description available] | medium | 1 | 0 | | |
trolamine salicylate | [no description available] | medium | 2 | 0 | | |
inositol 3-phosphate | [no description available] | medium | 4 | 1 | | |
ants | [no description available] | medium | 1 | 0 | | |
sodium ethylxanthate | [no description available] | medium | 1 | 0 | | |
vendex | [no description available] | medium | 1 | 0 | organotin acaricide | |
1-((3,5-dichloro)-2,6-dihydroxy-4-methoxyphenyl)-1-hexanone | [no description available] | medium | 1 | 0 | dichlorobenzene; differentiation-inducing factor; monomethoxybenzene; resorcinols | eukaryotic metabolite; signalling molecule |
metrizoate | [no description available] | low | 0 | 0 | monocarboxylic acid | radioopaque medium |
fluorescite | [no description available] | medium | 0 | 0 | benzoic acids; cyclic ketone; hydroxy monocarboxylic acid; organic heterotricyclic compound; phenols; xanthene dye | fluorescent dye; radioopaque medium |
iodamide | [no description available] | low | 0 | 0 | benzoic acids; organoiodine compound | radioopaque medium |
iodixanol | [no description available] | low | 0 | 0 | organoiodine compound | radioopaque medium |
iohexol | [no description available] | low | 0 | 0 | benzenedicarboxamide; organoiodine compound | environmental contaminant; radioopaque medium; xenobiotic |
iomeprol | [no description available] | low | 0 | 0 | benzenedicarboxamide; organoiodine compound | environmental contaminant; radioopaque medium; xenobiotic |
iopromide | [no description available] | low | 0 | 0 | dicarboxylic acid diamide; organoiodine compound | environmental contaminant; nephrotoxic agent; radioopaque medium; xenobiotic |
iodipamide | [no description available] | low | 0 | 0 | benzoic acids; organoiodine compound; secondary carboxamide | radioopaque medium |
ioxaglate | [no description available] | low | 0 | 0 | benzenedicarboxamide; benzoic acids; organoiodine compound | radioopaque medium |
perflexane | [no description available] | low | 0 | 0 | fluoroalkane; fluorocarbon; volatile organic compound | non-polar solvent; radioopaque medium |
perflubron | [no description available] | low | 0 | 0 | haloalkane; organobromine compound; perfluorinated compound | blood substitute; radioopaque medium |
perfluoropentane | [no description available] | low | 0 | 0 | fluoroalkane; fluorocarbon | radioopaque medium; ultrasound contrast agent |
ioxitalamic acid | [no description available] | low | 0 | 0 | acetamides; benzoic acids; dicarboxylic acid monoamide; organoiodine compound | environmental contaminant; radioopaque medium; xenobiotic |
iopamidol | [no description available] | low | 0 | 0 | benzenedicarboxamide; organoiodine compound; pentol | environmental contaminant; radioopaque medium; xenobiotic |
iobitridol | [no description available] | low | 0 | 0 | benzenedicarboxamide; hexol; organoiodine compound | environmental contaminant; radioopaque medium; xenobiotic |
meglumine iodipamide | [no description available] | low | 0 | 0 | organoammonium salt | radioopaque medium |
amidotrizoic acid dihydrate | [no description available] | low | 0 | 0 | hydrate | radioopaque medium |
sodium diatrizoate | [no description available] | low | 0 | 0 | organic sodium salt; organoiodine compound | radioopaque medium |
aminacrine | [no description available] | low | 0 | 0 | aminoacridines; primary amino compound | acid-base indicator; antiinfective agent; antiseptic drug; fluorescent dye; MALDI matrix material; mutagen |
n-(4-(7-diethylamino-4-methylcoumarin-3-yl)phenyl)maleimide | [no description available] | low | 0 | 0 | benzenes; coumarins; maleimides; tertiary amino compound | fluorescent dye |
picogreen | [no description available] | low | 0 | 0 | benzothiazoles; cyanine dye; quinolines; tertiary amine | fluorescent dye |
(E,E)-1-bromo-2,5-bis-(4-hydroxystyryl)benzene | [no description available] | medium | 0 | 0 | organobromine compound; polyphenol | fluorescent dye |
rhodamine 123 | [no description available] | low | 0 | 0 | organic chloride salt; xanthene dye | fluorochrome |
calcein am | [no description available] | low | 0 | 0 | 2-benzofurans; acetate ester; gamma-lactone; organic heteropentacyclic compound; oxaspiro compound; xanthene dye | fluorochrome |
rose bengal(2-) | [no description available] | low | 0 | 0 | monocarboxylic acid anion; xanthene dye | fluorochrome |
calcium orange | [no description available] | low | 0 | 0 | xanthene dye | fluorochrome |
glucono-1,4-lactone | [no description available] | low | 0 | 0 | gamma-lactone | |
patulin | [no description available] | low | 0 | 0 | furopyran; gamma-lactone; lactol | antimicrobial agent; Aspergillus metabolite; carcinogenic agent; mutagen; mycotoxin; Penicillium metabolite |
phthalide | [no description available] | low | 0 | 0 | 2-benzofurans; gamma-lactone | |
2-acetylbutyrolactone | [no description available] | low | 0 | 0 | gamma-lactone | |
decan-4-olide | [no description available] | low | 0 | 0 | gamma-lactone; tetrahydrofuranone | anticonvulsant; flavouring agent; food additive |
gamma-dodecalactone | [no description available] | low | 0 | 0 | gamma-lactone | bacterial metabolite; fungal metabolite; volatile oil component |
helenalin | [no description available] | low | 0 | 0 | cyclic ketone; gamma-lactone; organic heterotricyclic compound; secondary alcohol; sesquiterpene lactone | anti-inflammatory agent; antineoplastic agent; metabolite; plant metabolite |
4,5,6,7-tetrachlorophthalide | [no description available] | low | 0 | 0 | gamma-lactone; organic heterobicyclic compound; propan-1-ol; tetrachlorobenzene | antifungal agrochemical; melanin synthesis inhibitor |
zaluzanin C | [no description available] | low | 0 | 0 | gamma-lactone; guaiane sesquiterpenoid; organic heterotricyclic compound; secondary alcohol; sesquiterpene lactone | EC 1.14.13.39 (nitric oxide synthase) inhibitor; metabolite |
dehydrocostus lactone | [no description available] | low | 0 | 0 | gamma-lactone; guaiane sesquiterpenoid; organic heterotricyclic compound; sesquiterpene lactone | antimycobacterial drug; antineoplastic agent; apoptosis inducer; cyclooxygenase 2 inhibitor; metabolite; trypanocidal drug |
marrubiin | [no description available] | low | 0 | 0 | gamma-lactone | |
tutin | [no description available] | low | 0 | 0 | gamma-lactone | |
asperuloside | [no description available] | low | 0 | 0 | acetate ester; beta-D-glucoside; gamma-lactone; iridoid monoterpenoid; monosaccharide derivative | metabolite |
beta-peltatin | [no description available] | low | 0 | 0 | furonaphthodioxole; gamma-lactone; lignan; organic heterotetracyclic compound; phenols | antineoplastic agent; plant metabolite |
alpha-peltatin | [no description available] | low | 0 | 0 | furonaphthodioxole; gamma-lactone; lignan; organic heterotetracyclic compound; phenols | antineoplastic agent; metabolite |
matairesinol | [no description available] | low | 0 | 0 | gamma-lactone; lignan; polyphenol | angiogenesis inhibitor; anti-asthmatic agent; phytoestrogen; plant metabolite |
4'-demethyldesoxypodophyllotoxin | [no description available] | low | 0 | 0 | furonaphthodioxole; gamma-lactone; lignan; methoxybenzenes; phenols | antineoplastic agent; antioxidant; immunosuppressive agent; plant metabolite |
gulonolactone | [no description available] | low | 0 | 0 | gamma-lactone | |
confertin | [no description available] | low | 0 | 0 | cyclic ketone; gamma-lactone; organic heterotricyclic compound; pseudoguaianolide | anti-inflammatory agent; metabolite; plant metabolite |
2-ethyl-2-methyl-4-butyrolactone | [no description available] | low | 0 | 0 | gamma-lactone | |
inuviscolide | [no description available] | low | 0 | 0 | gamma-lactone; organic heterotricyclic compound; sesquiterpene lactone; tertiary alcohol | anti-inflammatory agent; plant metabolite |
top 53 | [no description available] | low | 0 | 0 | furonaphthodioxole; gamma-lactone; organic heterotetracyclic compound; phenols; tertiary amino compound | antineoplastic agent; EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor |
spirodiclofen | [no description available] | low | 0 | 0 | dichlorobenzene; gamma-lactone; organochlorine acaricide; oxaspiro compound | |
ergolide | [no description available] | low | 0 | 0 | acetate ester; cyclic ketone; gamma-lactone; organic heterotricyclic compound; sesquiterpene lactone | anti-inflammatory agent; antineoplastic agent; metabolite; NF-kappaB inhibitor; plant metabolite |
aromaticin | [no description available] | low | 0 | 0 | cyclic ketone; gamma-lactone; organic heterotricyclic compound; sesquiterpene lactone | anti-inflammatory agent; metabolite; plant metabolite |
anthricin | [no description available] | low | 0 | 0 | furonaphthodioxole; gamma-lactone; lignan; methoxybenzenes | antineoplastic agent; apoptosis inducer; plant metabolite |
picrotin | [no description available] | low | 0 | 0 | diol; epoxide; gamma-lactone; organic heteropentacyclic compound; picrotoxane sesquiterpenoid; tertiary alcohol | plant metabolite |
picrotoxinin | [no description available] | low | 0 | 0 | epoxide; gamma-lactone; organic heteropentacyclic compound; picrotoxane sesquiterpenoid; tertiary alcohol | GABA antagonist; plant metabolite; serotonergic antagonist |
hinokinin | [no description available] | low | 0 | 0 | benzodioxoles; gamma-lactone; lignan | trypanocidal drug |
eplerenone | [no description available] | low | 0 | 0 | 3-oxo-Delta(4) steroid; epoxy steroid; gamma-lactone; methyl ester; organic heteropentacyclic compound; oxaspiro compound; steroid acid ester | aldosterone antagonist; antihypertensive agent |
mycophenolic acid | [no description available] | low | 0 | 0 | 2-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 |
teniposide | [no description available] | low | 0 | 0 | aromatic 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 |
butylidenephthalide | [no description available] | low | 0 | 0 | 2-benzofurans; gamma-lactone | EC 3.2.1.20 (alpha-glucosidase) inhibitor; hypoglycemic agent; metabolite |
bigelovin | [no description available] | low | 0 | 0 | acetate ester; cyclic ketone; gamma-lactone; organic heterotricyclic compound; sesquiterpene lactone | antineoplastic agent; apoptosis inducer; immunomodulator; plant metabolite |
heparin | [no description available] | low | 0 | 0 | gamma-lactone | |
4-methylene-2-octyl-5-oxo-3-oxolanecarboxylic acid | [no description available] | low | 0 | 0 | gamma-lactone; monocarboxylic acid; tetrahydrofuranone | |
mycophenolate mofetil | [no description available] | low | 0 | 0 | carboxylic ester; ether; gamma-lactone; phenols; tertiary amino compound | anticoronaviral agent; EC 1.1.1.205 (IMP dehydrogenase) inhibitor; immunosuppressive agent; prodrug |
eupatolide | [no description available] | low | 0 | 0 | gamma-lactone; germacranolide; homoallylic alcohol; secondary alcohol | antineoplastic agent; plant metabolite |
pyrethrosin | [no description available] | low | 0 | 0 | gamma-lactone | |
savinin | [no description available] | low | 0 | 0 | benzodioxoles; gamma-lactone; lignan | anti-inflammatory agent; anticoronaviral agent; EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor; plant metabolite; T-cell proliferation inhibitor |
andrographolide | [no description available] | low | 0 | 0 | carbobicyclic compound; gamma-lactone; labdane diterpenoid; primary alcohol; secondary alcohol | anti-HIV agent; anti-inflammatory drug; antineoplastic agent; metabolite |
arglabin | [no description available] | low | 0 | 0 | epoxide; gamma-lactone; organic heterotetracyclic compound; sesquiterpene lactone | antineoplastic agent; metabolite |
himbacine | [no description available] | low | 0 | 0 | gamma-lactone; organic heterotricyclic compound; piperidine alkaloid | muscarinic antagonist |
thunberginol f | [no description available] | low | 0 | 0 | catechols; gamma-lactone; isobenzofuranone | metabolite; plant metabolite |
chaetoviridin a | [no description available] | low | 0 | 0 | azaphilone; beta-hydroxy ketone; enone; gamma-lactone; organic heterotricyclic compound; organochlorine compound; secondary alcohol | antifungal agent; Chaetomium metabolite |
hydroxyachillin | [no description available] | low | 0 | 0 | gamma-lactone | |
4-methylene-2-octyl-5-oxofuran-3-carboxylic acid | [no description available] | low | 0 | 0 | 4-methylidene-2-octyl-5-oxotetrahydrofuran-3-carboxylic acid; gamma-lactone | |
lactonamycin | [no description available] | low | 0 | 0 | gamma-lactone; organic heterohexacyclic compound; phenols; trideoxyhexose derivative | antibacterial agent; antimicrobial agent; metabolite |
sporothriolide | [no description available] | low | 0 | 0 | furofuran; gamma-lactone | antifungal agent; fungal metabolite |
bielschowskysin | [no description available] | low | 0 | 0 | acetate ester; cyclic acetal; diterpenoid; gamma-lactone; organic heterohexacyclic compound | antimalarial; antineoplastic agent; metabolite |
monascin | [no description available] | low | 0 | 0 | alpha,beta-unsaturated ketone; gamma-lactone; organic heterotricyclic compound; polyketide | antilipemic drug; antineoplastic agent; fungal metabolite; PPARgamma agonist |
monascorubrin | [no description available] | low | 0 | 0 | azaphilone; enone; gamma-lactone; polyketide; triketone | anti-inflammatory agent; antineoplastic agent; biological pigment; food colouring; fungal metabolite; Hsp90 inhibitor |
3-furancarboxylic acid, tetrahydro-4-methylene-5-oxo-2-propyl-, (2r,3s)-rel- | [no description available] | low | 0 | 0 | gamma-lactone | |
4'-epichaetoviridin A | [no description available] | low | 0 | 0 | azaphilone; beta-hydroxy ketone; enone; gamma-lactone; organic heterotricyclic compound; organochlorine compound; secondary alcohol | Chaetomium metabolite |
albiflorin | [no description available] | low | 0 | 0 | benzoate ester; beta-D-glucoside; bridged compound; gamma-lactone; monoterpene glycoside; secondary alcohol | neuroprotective agent; plant metabolite |
(3S,3Ar,4S,9aS,9bR)-4-hydroxy-3,6,9-trimethyl-3,3a,4,5-tetrahydroazuleno[4,5-b]furan-2,7(9aH,9bH)-dione hydrate | [no description available] | low | 0 | 0 | gamma-lactone | |
chaetoviridin E | [no description available] | low | 0 | 0 | azaphilone; enone; gamma-lactone; organic heterotricyclic compound; organochlorine compound | Chaetomium metabolite |
salvileucalin b | [no description available] | low | 0 | 0 | bridged compound; diterpenoid; furans; gamma-lactone | antineoplastic agent; metabolite |
fumimycin | [no description available] | low | 0 | 0 | 1-benzofurans; dicarboxylic acid monoamide; gamma-lactone; monocarboxylic acid; polyphenol | antibacterial agent; Aspergillus metabolite; EC 3.5.1.88 (peptide deformylase) inhibitor |
sphaeropsidin a | [no description available] | low | 0 | 0 | gamma-lactone | metabolite |
carlactone | [no description available] | low | 0 | 0 | cyclic acetal; gamma-lactone | plant hormone |
lancifodilactone g | [no description available] | low | 0 | 0 | cyclic ether; diol; enol; gamma-lactone; oxaspiro compound; triterpenoid | anti-HIV agent; metabolite |
nephrosteranic acid | [no description available] | low | 0 | 0 | gamma-lactone | |
4',7-dihydroxyflavanone | [no description available] | low | 0 | 0 | 4'-hydroxyflavanones; dihydroxyflavanone; polyphenol | Brassica napus metabolite; fungal xenobiotic metabolite |
bithionol | [no description available] | low | 0 | 0 | aryl sulfide; bridged diphenyl antifungal drug; bridged diphenyl fungicide; dichlorobenzene; organochlorine pesticide; polyphenol | antifungal agrochemical; antiplatyhelmintic drug |
hexachlorophene | [no description available] | low | 0 | 0 | bridged diphenyl fungicide; polyphenol; trichlorobenzene | acaricide; antibacterial agent; antifungal agrochemical; antiseptic drug |
probucol | [no description available] | low | 0 | 0 | dithioketal; polyphenol | anti-inflammatory drug; anticholesteremic drug; antilipemic drug; antioxidant; cardiovascular drug |
resveratrol | [no description available] | low | 0 | 0 | polyphenol; resorcinols; stilbenol | antioxidant; geroprotector; glioma-associated oncogene inhibitor; phytoalexin |
bromthymol blue | [no description available] | low | 0 | 0 | 2,1-benzoxathiole; arenesulfonate ester; organobromine compound; polyphenol; sultone | acid-base indicator; dye; two-colour indicator |
fentichlor | [no description available] | low | 0 | 0 | aryl sulfide; bridged diphenyl antifungal drug; monochlorobenzenes; polyphenol | antiinfective agent; drug allergen |
bromcresol purple | [no description available] | low | 0 | 0 | 2,1-benzoxathiole; arenesulfonate ester; organobromine compound; polyphenol; sultone | acid-base indicator; dye; two-colour indicator |
usnic acid | [no description available] | low | 0 | 0 | dibenzofurans; methyl ketone; polyphenol | acaricide; antifungal agent; lichen metabolite |
silybin | [no description available] | low | 0 | 0 | aromatic ether; benzodioxine; flavonolignan; polyphenol; secondary alpha-hydroxy ketone | antineoplastic agent; antioxidant; hepatoprotective agent; plant metabolite |
du-21220 | [no description available] | low | 0 | 0 | benzyl alcohols; polyphenol; secondary alcohol; secondary amino compound | |
ractopamine | [no description available] | low | 0 | 0 | benzyl alcohols; polyphenol; secondary alcohol; secondary amino compound | |
epicatechin | [no description available] | low | 0 | 0 | catechin; polyphenol | antioxidant |
9,9-bis(4-hydroxyphenyl)fluorene | [no description available] | low | 0 | 0 | fluorenes; polyphenol | anti-estrogen |
eupatorin | [no description available] | low | 0 | 0 | dihydroxyflavone; polyphenol; trimethoxyflavone | anti-inflammatory agent; antineoplastic agent; apoptosis inducer; Brassica napus metabolite; calcium channel blocker; P450 inhibitor; vasodilator agent |
atromentin | [no description available] | low | 0 | 0 | dihydroxy-1,4-benzoquinones; polyphenol | antibacterial agent; anticoagulant; antineoplastic agent; apoptosis inducer; biological pigment; EC 1.3.1.9 [enoyl-[acyl-carrier-protein] reductase (NADH)] inhibitor; fungal metabolite |
rhodomycinone | [no description available] | low | 0 | 0 | carbopolycyclic compound; methyl ester; polyphenol; tetracenequinones; tetracenomycin | |
syringaresinol | [no description available] | low | 0 | 0 | aromatic ether; furofuran; lignan; polyether; polyphenol | plant metabolite |
versicolorin c | [no description available] | low | 0 | 0 | cyclic acetal; organic heteropentacyclic compound; p-quinones; polyphenol | Aspergillus metabolite |
versiconal hemiacetal acetate | [no description available] | low | 0 | 0 | acetate ester; anthrafuran; lactol; palmitoyl amino acid; polyphenol | metabolite |
ecteinascidin 743 | [no description available] | low | 0 | 0 | acetate 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 |
procyanidin b2 | [no description available] | low | 0 | 0 | biflavonoid; hydroxyflavan; polyphenol; proanthocyanidin | antioxidant; metabolite |
procyanidin b5 | [no description available] | low | 0 | 0 | biflavonoid; hydroxyflavan; polyphenol; proanthocyanidin | metabolite |
swertisin | [no description available] | low | 0 | 0 | dihydroxyflavone; flavone C-glycoside; monomethoxyflavone; monosaccharide derivative; polyphenol | adenosine A1 receptor antagonist; anti-inflammatory agent; antioxidant; hypoglycemic agent; plant metabolite |
tetrahydrocurcumin | [no description available] | low | 0 | 0 | beta-diketone; diarylheptanoid; polyphenol | metabolite |
alteichin | [no description available] | low | 0 | 0 | polyphenol | |
cercosporamide | [no description available] | low | 0 | 0 | dibenzofurans; methyl ketone; monocarboxylic acid amide; polyphenol | antifungal agent; EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor; fungal metabolite; phytotoxin |
marsupsin | [no description available] | low | 0 | 0 | 1-benzofurans; aromatic ether; polyphenol | antilipemic drug; hypoglycemic agent; metabolite |
procyanidin b3 | [no description available] | low | 0 | 0 | biflavonoid; hydroxyflavan; polyphenol; proanthocyanidin | anti-inflammatory agent; antioxidant; EC 2.3.1.48 (histone acetyltransferase) inhibitor; metabolite |
acrovestone | [no description available] | low | 0 | 0 | acetophenones; aromatic ether; olefinic compound; polyphenol | antioxidant; EC 1.14.18.1 (tyrosinase) inhibitor; plant metabolite |
corytuberine | [no description available] | low | 0 | 0 | aporphine alkaloid; aromatic ether; organic heterotetracyclic compound; polyphenol; tertiary amino compound | plant metabolite |
isolariciresinol | [no description available] | low | 0 | 0 | guaiacols; lignan; polyphenol; primary alcohol | plant metabolite |
2',6'-dihydroxy-4'-methoxydihydrochalcone | [no description available] | low | 0 | 0 | dihydrochalcones; monomethoxybenzene; polyphenol | antiplasmodial drug; radical scavenger |
procyanidin C1 | [no description available] | low | 0 | 0 | hydroxyflavan; polyphenol; proanthocyanidin | anti-inflammatory agent; antioxidant; EC 1.17.3.2 (xanthine oxidase) inhibitor; EC 3.2.1.20 (alpha-glucosidase) inhibitor; lipoxygenase inhibitor; metabolite |
medioresinol | [no description available] | low | 0 | 0 | dimethoxybenzene; furofuran; lignan; polyphenol | plant metabolite |
(+)-epicatechin | [no description available] | low | 0 | 0 | catechin; polyphenol | cyclooxygenase 1 inhibitor; plant metabolite |
chloroorienticin b | [no description available] | low | 0 | 0 | cyclic ether; glycopeptide; heterodetic cyclic peptide; monosaccharide derivative; organochlorine compound; polyphenol | antimicrobial agent; bacterial metabolite |
(-)-gallocatechin gallate | [no description available] | low | 0 | 0 | catechin; gallate ester; polyphenol | antineoplastic agent; EC 3.4.22.69 (SARS coronavirus main proteinase) inhibitor; human xenobiotic metabolite; plant metabolite |
norbelladine | [no description available] | low | 0 | 0 | catechols; phenethylamine alkaloid; polyphenol; secondary amino compound | plant metabolite |
silychristin | [no description available] | low | 0 | 0 | 1-benzofurans; aromatic ether; flavonolignan; polyphenol; secondary alpha-hydroxy ketone | lipoxygenase inhibitor; metabolite; prostaglandin antagonist; radical scavenger |
davidigenin | [no description available] | low | 0 | 0 | dihydrochalcones; polyphenol | anti-allergic agent; anti-asthmatic agent; antioxidant; metabolite |
knipholone | [no description available] | low | 0 | 0 | aromatic ketone; dihydroxyanthraquinone; methoxybenzenes; methyl ketone; polyphenol; resorcinols | antineoplastic agent; antioxidant; antiplasmodial drug; leukotriene antagonist; metabolite |
aglucovancomycin b | [no description available] | low | 0 | 0 | cyclic ether; heterodetic cyclic peptide; peptide antibiotic; peptide zwitterion; polyphenol | metabolite |
5,11-diethyl-5,6,11,12-tetrahydrochrysene-2,8-diol | [no description available] | low | 0 | 0 | carbotetracyclic compound; polyphenol | estrogen receptor agonist; estrogen receptor antagonist; geroprotector; neuroprotective agent |
pallidol | [no description available] | low | 0 | 0 | carbopolycyclic compound; polyphenol; stilbenoid | antifungal agent; antioxidant; plant metabolite |
averufin | [no description available] | low | 0 | 0 | cyclic ketal; organic heteropentacyclic compound; polyketide; polyphenol | fungal metabolite |
versicolorin a | [no description available] | low | 0 | 0 | cyclic acetal; organic heteropentacyclic compound; p-quinones; polyphenol | Aspergillus metabolite; carcinogenic agent |
xanthohumol | [no description available] | low | 0 | 0 | aromatic ether; chalcones; polyphenol | anti-HIV-1 agent; antineoplastic agent; antiviral agent; apoptosis inducer; EC 2.3.1.20 (diacylglycerol O-acyltransferase) inhibitor; metabolite |
3,3',4,5'-tetrahydroxystilbene | [no description available] | low | 0 | 0 | catechols; polyphenol; resorcinols; stilbenol | antineoplastic agent; apoptosis inducer; geroprotector; hypoglycemic agent; plant metabolite; protein kinase inhibitor; tyrosine kinase inhibitor |
adefovir | [no description available] | low | 0 | 0 | aromatic ether; aromatic ketone; biaryl; cyclic ketone; naphtho-gamma-pyrone; organooxygen heterocyclic antibiotic; polyphenol | antimalarial; Aspergillus metabolite; marine metabolite |
catechin gallate | [no description available] | low | 0 | 0 | flavans; gallate ester; polyphenol | metabolite |
gallocatechin-3-gallate | [no description available] | low | 0 | 0 | catechin; gallate ester; polyphenol | plant metabolite |
naringenin chalcone | [no description available] | low | 0 | 0 | chalcones; polyphenol | anti-allergic agent; anti-inflammatory agent; metabolite |
butein | [no description available] | low | 0 | 0 | chalcones; polyphenol | antineoplastic agent; antioxidant; EC 1.1.1.21 (aldehyde reductase) inhibitor; geroprotector; hypoglycemic agent; plant metabolite; radiosensitizing agent; tyrosine kinase inhibitor |
isobavachalcone | [no description available] | low | 0 | 0 | chalcones; polyphenol | antibacterial agent; metabolite; platelet aggregation inhibitor |
bellidifolin | [no description available] | low | 0 | 0 | polyphenol; xanthones | EC 3.1.1.7 (acetylcholinesterase) inhibitor; hypoglycemic agent; metabolite |
gartanin | [no description available] | low | 0 | 0 | polyphenol; xanthones | antineoplastic agent; plant metabolite |
gentiacaulein | [no description available] | low | 0 | 0 | aromatic ether; polyphenol; xanthones | plant metabolite |
gentisein | [no description available] | low | 0 | 0 | polyphenol; xanthones | plant metabolite |
gentisin | [no description available] | low | 0 | 0 | aromatic ether; polyphenol; xanthones | plant metabolite |
isogentisin | [no description available] | low | 0 | 0 | aromatic ether; polyphenol; xanthones | EC 1.4.3.4 (monoamine oxidase) inhibitor; plant metabolite |
1,8-dihydroxy-3,7-dimethoxyxanthone | [no description available] | low | 0 | 0 | aromatic ether; polyphenol; xanthones | plant metabolite |
norathyriol | [no description available] | low | 0 | 0 | polyphenol; xanthones | antineoplastic agent; EC 2.7.11.13 (protein kinase C) inhibitor; plant metabolite |
norlichexanthone | [no description available] | low | 0 | 0 | polyphenol; xanthones | antimalarial; fungal metabolite |
1,2,8-trihydroxy-6-methoxyxanthone | [no description available] | low | 0 | 0 | aromatic ether; polyphenol; xanthones | antioxidant; plant metabolite |
coumestrol | [no description available] | low | 0 | 0 | coumestans; delta-lactone; polyphenol | anti-inflammatory agent; antioxidant; plant metabolite |
astringin | [no description available] | low | 0 | 0 | beta-D-glucoside; monosaccharide derivative; polyphenol; stilbenoid | antineoplastic agent; antioxidant; metabolite |
polydatin | [no description available] | low | 0 | 0 | beta-D-glucoside; monosaccharide derivative; polyphenol; stilbenoid | anti-arrhythmia drug; antioxidant; geroprotector; hepatoprotective agent; metabolite; nephroprotective agent; potassium channel modulator |
epsilon-viniferin | [no description available] | low | 0 | 0 | 1-benzofurans; polyphenol; stilbenoid | metabolite |
acteoside | [no description available] | low | 0 | 0 | catechols; cinnamate ester; disaccharide derivative; glycoside; polyphenol | anti-inflammatory agent; antibacterial agent; antileishmanial agent; neuroprotective agent; plant metabolite |
psoralidin | [no description available] | low | 0 | 0 | coumestans; delta-lactone; polyphenol | estrogen receptor agonist; plant metabolite |
wedelolactone | [no description available] | low | 0 | 0 | aromatic ether; coumestans; delta-lactone; polyphenol | antineoplastic agent; apoptosis inducer; EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor; hepatoprotective agent; metabolite |
(+)-trans-epsilon-viniferin | [no description available] | low | 0 | 0 | 1-benzofurans; polyphenol; stilbenoid | |
bisdemethoxycurcumin | [no description available] | low | 0 | 0 | beta-diketone; diarylheptanoid; enone; polyphenol | EC 3.2.1.1 (alpha-amylase) inhibitor; metabolite |
rosmarinic acid | [no description available] | low | 0 | 0 | carboxylic ester; monocarboxylic acid; phenylpropanoid; polyphenol | antioxidant; EC 1.1.1.21 (aldehyde reductase) inhibitor; non-steroidal anti-inflammatory drug; peripheral nervous system drug; plant metabolite; serine proteinase inhibitor |
quadrangularin a | [no description available] | low | 0 | 0 | indanes; polyphenol; stilbenoid | antioxidant; plant metabolite |
isomangiferin | [no description available] | low | 0 | 0 | C-glycosyl compound; polyphenol; xanthones | anti-HSV-1 agent; plant metabolite |
neoglycyrol | [no description available] | low | 0 | 0 | aromatic ether; coumestans; delta-lactone; polyphenol | antineoplastic agent; plant metabolite |
benanomicin b | [no description available] | low | 0 | 0 | aromatic ether; disaccharide derivative; L-alanine derivative; polyketide; polyphenol; pradimicin; secondary alcohol | |
pradimicin b | [no description available] | low | 0 | 0 | aromatic ether; L-alanine derivative; monosaccharide derivative; polyketide; polyphenol; pradimicin; secondary alcohol | |
demethoxycurcumin | [no description available] | low | 0 | 0 | beta-diketone; diarylheptanoid; enone; polyphenol | anti-inflammatory agent; antineoplastic agent; metabolite |
tetrahydroxycurcumin | [no description available] | low | 0 | 0 | beta-diketone; catechols; diarylheptanoid; enone; polyphenol | anti-inflammatory agent; neuroprotective agent; plant metabolite |
pradimicin a | [no description available] | low | 0 | 0 | aromatic ether; carboxylic acid; disaccharide derivative; L-alanine derivative; p-quinones; polyphenol; pradimicin; secondary alcohol | |
lespenefril | [no description available] | low | 0 | 0 | alpha-L-rhamnoside; dihydroxyflavone; glycosyloxyflavone; monosaccharide derivative; polyphenol | anti-inflammatory agent; antidepressant; antineoplastic agent; apoptosis inducer; bone density conservation agent; hypoglycemic agent; immunomodulator; plant metabolite |
4-hydroxycordoin | [no description available] | low | 0 | 0 | aromatic ether; chalcones; polyphenol | anti-inflammatory agent; antibacterial agent; plant metabolite |
rifamycin sv | [no description available] | low | 0 | 0 | acetate ester; cyclic ketal; lactam; macrocycle; organic heterotetracyclic compound; polyphenol; rifamycins | antimicrobial agent; antitubercular agent; bacterial metabolite |
(-)-catechin-3-O-gallate | [no description available] | low | 0 | 0 | flavans; gallate ester; polyphenol | metabolite |
salvianolic acid B | [no description available] | low | 0 | 0 | 1-benzofurans; catechols; dicarboxylic acid; enoate ester; polyphenol | anti-inflammatory agent; antidepressant; antineoplastic agent; antioxidant; apoptosis inducer; autophagy inhibitor; cardioprotective agent; hepatoprotective agent; hypoglycemic agent; neuroprotective agent; osteogenesis regulator; plant metabolite |
altenusin | [no description available] | low | 0 | 0 | aromatic ether; carboxybiphenyl; catechols; hydroxybiphenyls; polyphenol | antifungal agent; fungal metabolite |
rubraxanthone | [no description available] | low | 0 | 0 | aromatic ether; polyphenol; xanthones | antibacterial agent; antineoplastic agent; metabolite |
hetacillin | [no description available] | low | 0 | 0 | guaiacols; lignan; oxolanes; polyphenol; tetrol | plant metabolite |
delta-viniferin | [no description available] | low | 0 | 0 | 1-benzofurans; polyphenol; stilbenoid | |
fonsecinone a | [no description available] | low | 0 | 0 | aromatic ether; aromatic ketone; biaryl; cyclic ketone; naphtho-gamma-pyrone; polyphenol | antibacterial agent; Aspergillus metabolite |
dihydroxanthohumol | [no description available] | low | 0 | 0 | aromatic ether; dihydrochalcones; polyphenol | EC 1.14.13.39 (nitric oxide synthase) inhibitor; metabolite |
(+)-lyoniresinol-3-alpha-O-beta-D-glucopyranoside | [no description available] | low | 0 | 0 | beta-D-glucoside; dimethoxybenzene; lignan; monosaccharide derivative; polyphenol; primary alcohol; tetralins | antibacterial agent; antifungal agent; metabolite |
2,3,6,8-tetrahydroxy-1-(3-methylbut-2-enyl)-5-(2-methylbut-3-en-2-yl)-9h-xanthen-9-one | [no description available] | low | 0 | 0 | polyphenol; xanthones | anti-inflammatory agent; antineoplastic agent; EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor; metabolite |
procyanidin b1 | [no description available] | low | 0 | 0 | biflavonoid; hydroxyflavan; polyphenol; proanthocyanidin | anti-inflammatory agent; EC 3.4.21.5 (thrombin) inhibitor; metabolite |
aspalathin | [no description available] | low | 0 | 0 | C-glycosyl compound; catechols; dihydrochalcones; polyketide; polyphenol | antioxidant; EC 1.17.3.2 (xanthine oxidase) inhibitor; hypoglycemic agent; plant metabolite |
liphagal | [no description available] | low | 0 | 0 | aldehyde; cyclic ether; meroterpenoid; organic heterotetracyclic compound; polyphenol | EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor; metabolite |
lyoniresinol | [no description available] | low | 0 | 0 | dimethoxybenzene; lignan; polyphenol; primary alcohol; tetralins | antineoplastic agent; metabolite |
complestatin | [no description available] | low | 0 | 0 | cyclic 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] | low | 0 | 0 | cyclic ether; heterodetic cyclic peptide; indoles; organochlorine compound; polyphenol | HIV-1 integrase inhibitor; metabolite |
tricin 4'-o-(threo-beta-guaiacylglyceryl) ether | [no description available] | low | 0 | 0 | dimethoxybenzene; flavonolignan; polyphenol; primary alcohol; secondary alcohol | plant metabolite |
5,7-dihydroxy-3-(3-hydroxy-4-methoxybenzyl)-6-methoxychroman-4-one | [no description available] | low | 0 | 0 | aromatic ether; homoisoflavonoid; polyphenol | angiogenesis modulating agent; plant metabolite |
mycocyclosin | [no description available] | low | 0 | 0 | 2,5-diketopiperazines; organic heterotetracyclic compound; polyphenol | metabolite |
scytonemin | [no description available] | low | 0 | 0 | enone; organic heterotricyclic compound; organonitrogen heterocyclic compound; polyphenol; ring assembly | bacterial metabolite; biological pigment; ultraviolet filter |
hydrazinocurcumin | [no description available] | low | 0 | 0 | aromatic ether; olefinic compound; polyphenol; pyrazoles | angiogenesis modulating agent; antineoplastic agent; EC 2.3.1.48 (histone acetyltransferase) inhibitor; EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor |
spironolactone | [no description available] | low | 0 | 0 | 3-oxo-Delta(4) steroid; oxaspiro compound; steroid lactone; thioester | aldosterone antagonist; antihypertensive agent; diuretic; environmental contaminant; xenobiotic |
tomatidine | [no description available] | low | 0 | 0 | 3beta-hydroxy steroid; azaspiro compound; oxaspiro compound | |
fluoran | [no description available] | low | 0 | 0 | 2-benzofurans; oxaspiro compound; xanthenes | |
remikiren | [no description available] | low | 0 | 0 | azaspiro compound; oxaspiro compound; steroid | |
u 69593 | [no description available] | low | 0 | 0 | monocarboxylic acid amide; N-alkylpyrrolidine; organic heterobicyclic compound; oxaspiro compound | anti-inflammatory agent; diuretic; kappa-opioid receptor agonist |
hippurin | [no description available] | low | 0 | 0 | oxaspiro compound; steroid | |
bisdechlorogeodin | [no description available] | low | 0 | 0 | 1-benzofurans; cyclohexadiene; methyl ester; oxaspiro compound | antimicrobial agent |
solasodine | [no description available] | low | 0 | 0 | alkaloid antibiotic; azaspiro compound; hemiaminal ether; oxaspiro compound; sapogenin; steroid alkaloid | anticonvulsant; antifungal agent; antiinfective agent; antioxidant; antipyretic; antispermatogenic agent; apoptosis inducer; cardiotonic drug; central nervous system depressant; diuretic; immunomodulator; plant metabolite; teratogenic agent |
6-amino-3-(methoxymethyl)-5-spiro[2H-pyrano[2,3-c]pyrazole-4,4'-thiane]carbonitrile | [no description available] | low | 0 | 0 | nitrile; organic sulfide; organosulfur heterocyclic compound; oxaspiro compound | |
pseurotin | [no description available] | low | 0 | 0 | azaspiro compound; lactam; oxaspiro compound | metabolite |
estin | [no description available] | low | 0 | 0 | 1-benzofurans; ether; methyl ester; organochlorine compound; oxaspiro compound; phenols | Aspergillus metabolite; Penicillium metabolite |
trachyspic acid | [no description available] | low | 0 | 0 | oxaspiro compound; tricarboxylic acid | EC 3.2.1.166 (heparanase) inhibitor; fungal metabolite |
esculeoside a | [no description available] | low | 0 | 0 | azaspiro compound; oxaspiro compound; saponin; steroid alkaloid; steroid saponin | antineoplastic agent; metabolite |
fumiquinazoline c | [no description available] | low | 0 | 0 | azaspiro compound; fumiquinazoline; imidazoindole; organic heteroheptacyclic compound; oxaspiro compound | |
avilamycin a | [no description available] | low | 0 | 0 | benzoate ester; cyclic acetal; dichlorobenzene; oligosaccharide derivative; ortho ester; oxaspiro compound; phenols; tertiary alpha-hydroxy ketone | antimicrobial agent; bacterial metabolite |
AZD1979 | [no description available] | low | 0 | 0 | aromatic ether; azaspiro compound; carboxamide; N-acylazetidine; oxadiazole; oxaspiro compound; oxetanes | melanin-concentrating hormone receptor antagonist |
boromycin | [no description available] | low | 0 | 0 | macrodiolide; macrolide antibiotic; organoboron compound; oxaspiro compound; zwitterion | anti-HIV agent; antibacterial agent; bacterial metabolite |
marineosin a | [no description available] | low | 0 | 0 | azaspiro compound; ether; macrocycle; oxaspiro compound; pyrroles | antineoplastic agent; metabolite |
marineosin b | [no description available] | low | 0 | 0 | azaspiro compound; ether; macrocycle; oxaspiro compound; pyrroles | antineoplastic agent; metabolite |
6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid 2-(4-morpholinyl)ethyl ester | [no description available] | low | 0 | 0 | 2-benzofurans | |
6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-isobenzofuran-5-yl)-4-methyl-4-hexenoic acid | [no description available] | low | 0 | 0 | 2-benzofurans | |
sulfobromophthalein | [no description available] | low | 0 | 0 | 2-benzofurans; organobromine compound; organosulfonic acid; phenols | dye |
phthalic anhydride | [no description available] | low | 0 | 0 | 2-benzofurans; cyclic dicarboxylic anhydride | allergen |
trimellitic anhydride | [no description available] | low | 0 | 0 | 2-benzofurans; cyclic dicarboxylic anhydride; dioxo monocarboxylic acid | allergen; epitope; hapten |
tetrabromophthalic anhydride | [no description available] | low | 0 | 0 | 2-benzofurans; cyclic dicarboxylic anhydride | |
meconin | [no description available] | low | 0 | 0 | 2-benzofurans | |
fraxinellone | [no description available] | low | 0 | 0 | 2-benzofurans | |
5,6-dimethoxy-3H-isobenzofuran-1-one | [no description available] | low | 0 | 0 | 2-benzofurans | |
3-Furan-3-yl-3a,7-dimethyl-3a,4,5,6-tetrahydro-3H-isobenzofuran-1-one | [no description available] | low | 0 | 0 | 2-benzofurans | |
4,6-Dimethoxy-phthalide | [no description available] | low | 0 | 0 | 2-benzofurans | |
(3z,6alpha,7alpha)-isomer of 3-butylidene-4,5,6,7-tetrahydro-6,7-dihydroxy-1(3h)-isobenzofuranone | [no description available] | low | 0 | 0 | 2-benzofurans | |
deberza | [no description available] | low | 0 | 0 | 2-benzofurans | |
asperfuranone | [no description available] | low | 0 | 0 | 2-benzofurans; cyclic ketone; diol; polyketide; secondary alcohol; tertiary alcohol; tertiary alpha-hydroxy ketone | antineoplastic agent; fungal metabolite |
chetomin | [no description available] | low | 0 | 0 | indoles; organic disulfide; organic heteropentacyclic compound | Chaetomium metabolite; immunosuppressive agent |
amberlite cg 400 | [no description available] | low | 0 | 0 | methyl ester; organic heteropentacyclic compound; yohimban alkaloid | |
vincristine | [no description available] | low | 0 | 0 | acetate 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 |
fluocinolone acetonide | [no description available] | low | 0 | 0 | 11beta-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 |
gibberellic acid | [no description available] | low | 0 | 0 | C19-gibberellin; gibberellin monocarboxylic acid; lactone; organic heteropentacyclic compound | mouse metabolite; plant metabolite |
deserpidine | [no description available] | low | 0 | 0 | alkaloid ester; benzoate ester; methyl ester; organic heteropentacyclic compound; yohimban alkaloid | |
liriodenine | [no description available] | low | 0 | 0 | alkaloid antibiotic; cyclic ketone; organic heteropentacyclic compound; oxacycle; oxoaporphine alkaloid | antifungal agent; antimicrobial agent; antineoplastic agent; EC 3.1.1.7 (acetylcholinesterase) inhibitor; EC 3.2.1.20 (alpha-glucosidase) inhibitor; metabolite |
vincamine | [no description available] | low | 0 | 0 | alkaloid ester; hemiaminal; methyl ester; organic heteropentacyclic compound; vinca alkaloid | antihypertensive agent; metabolite; vasodilator agent |
tabersonine | [no description available] | low | 0 | 0 | alkaloid ester; methyl ester; monoterpenoid indole alkaloid; organic heteropentacyclic compound | antineoplastic agent; metabolite |
stanozolol | [no description available] | low | 0 | 0 | 17beta-hydroxy steroid; anabolic androgenic steroid; organic heteropentacyclic compound; tertiary alcohol | anabolic agent; androgen |
canadine | [no description available] | low | 0 | 0 | aromatic ether; berberine alkaloid; organic heteropentacyclic compound; oxacycle | |
butaclamol | [no description available] | low | 0 | 0 | organic heteropentacyclic compound | |
butaclamol | [no description available] | low | 0 | 0 | amino alcohol; organic heteropentacyclic compound; tertiary alcohol; tertiary amino compound | dopaminergic antagonist |
vindesine | [no description available] | low | 0 | 0 | methyl ester; organic heteropentacyclic compound; organic heterotetracyclic compound; primary carboxamide; tertiary alcohol; tertiary amino compound; vinca alkaloid | antineoplastic agent |
cephalotaxine | [no description available] | low | 0 | 0 | benzazepine alkaloid fundamental parent; benzazepine alkaloid; cyclic acetal; enol ether; organic heteropentacyclic compound; secondary alcohol; tertiary amino compound | |
siccanin | [no description available] | low | 0 | 0 | organic heteropentacyclic compound | antifungal drug; fungal metabolite |
tetrahydroalstonine | [no description available] | low | 0 | 0 | methyl ester; organic heteropentacyclic compound; yohimban alkaloid | plant metabolite |
voacamine | [no description available] | low | 0 | 0 | alkaloid ester; methyl ester; monoterpenoid indole alkaloid; organic heteropentacyclic compound; tertiary amino compound | angiogenesis inhibitor; antineoplastic agent; plant metabolite |
tylophorine | [no description available] | low | 0 | 0 | organic heteropentacyclic compound; organonitrogen heterocyclic compound | |
cryptopleurine | [no description available] | low | 0 | 0 | alkaloid antibiotic; alkaloid; aromatic ether; organic heteropentacyclic compound | antineoplastic agent; antiviral agent; protein synthesis inhibitor |
sporidesmin | [no description available] | low | 0 | 0 | aromatic ether; cyclic ketone; diketone; organic disulfide; organic heteropentacyclic compound; organochlorine compound; secondary alcohol; tertiary alcohol; tertiary amino compound | mycotoxin; Wnt signalling activator |
fumitremorgin b | [no description available] | low | 0 | 0 | indole alkaloid; organic heteropentacyclic compound | mycotoxin |
deguelin | [no description available] | low | 0 | 0 | aromatic ether; diether; organic heteropentacyclic compound; rotenones | angiogenesis inhibitor; anti-inflammatory agent; antineoplastic agent; antiviral agent; apoptosis inducer; EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor; mitochondrial NADH:ubiquinone reductase inhibitor; plant metabolite |
cafestol | [no description available] | low | 0 | 0 | diterpenoid; furans; organic heteropentacyclic compound; primary alcohol; tertiary alcohol | angiogenesis inhibitor; anti-inflammatory agent; antineoplastic agent; antioxidant; apoptosis inducer; hypoglycemic agent; plant metabolite |
kahweol | [no description available] | low | 0 | 0 | diterpenoid; furans; organic heteropentacyclic compound; primary alcohol; tertiary alcohol | angiogenesis inhibitor; anti-inflammatory agent; antineoplastic agent; antioxidant; apoptosis inducer; plant metabolite |
tephrosin | [no description available] | low | 0 | 0 | aromatic ether; cyclic ketone; organic heteropentacyclic compound; rotenones | antineoplastic agent; metabolite; pesticide |
actinodaphine | [no description available] | low | 0 | 0 | aporphine alkaloid; aromatic ether; organic heteropentacyclic compound; phenols; secondary amino compound | antibacterial agent; antifungal agent; antineoplastic agent; apoptosis inducer; plant metabolite; platelet aggregation inhibitor; topoisomerase inhibitor |
anonaine | [no description available] | low | 0 | 0 | aporphine alkaloid; organic heteropentacyclic compound; oxacycle | antineoplastic agent; antiplasmodial drug; trypanocidal drug |
glyceollin | [no description available] | low | 0 | 0 | organic heteropentacyclic compound | |
diflomotecan | [no description available] | low | 0 | 0 | epsilon-lactone; organic heteropentacyclic compound; organofluorine compound; organonitrogen heterocyclic compound; tertiary alcohol | antineoplastic agent; EC 5.99.1.2 (DNA topoisomerase) inhibitor |
vincaleukoblastine | [no description available] | low | 0 | 0 | acetate ester; indole alkaloid fundamental parent; methyl ester; organic heteropentacyclic compound; organic heterotetracyclic compound; tertiary alcohol; tertiary amino compound; vinca alkaloid | antineoplastic agent; immunosuppressive agent; microtubule-destabilising agent; plant metabolite |
homoharringtonine | [no description available] | low | 0 | 0 | alkaloid ester; enol ether; organic heteropentacyclic compound; tertiary alcohol | anticoronaviral agent; antineoplastic agent; apoptosis inducer; protein synthesis inhibitor |
tryptoquivaline | [no description available] | low | 0 | 0 | aromatic ether; indole alkaloid; organic heteropentacyclic compound | breast cancer resistance protein inhibitor; mycotoxin |
hippeastrine | [no description available] | low | 0 | 0 | delta-lactone; indole alkaloid; organic heteropentacyclic compound; secondary alcohol | antineoplastic agent; metabolite |
glaucarubinone | [no description available] | low | 0 | 0 | carboxylic ester; organic heteropentacyclic compound; quassinoid; secondary alpha-hydroxy ketone; tertiary alpha-hydroxy ketone; tetrol | antimalarial; antineoplastic agent; geroprotector; plant metabolite |
raubasine | [no description available] | low | 0 | 0 | methyl ester; monoterpenoid indole alkaloid; organic heteropentacyclic compound | alpha-adrenergic antagonist; antihypertensive agent; vasodilator agent |
antofine | [no description available] | low | 0 | 0 | alkaloid antibiotic; alkaloid; aromatic ether; organic heteropentacyclic compound | angiogenesis inhibitor; anti-inflammatory agent; antimicrobial agent; antineoplastic agent; antiviral agent; phytotoxin; plant metabolite |
noribogaine | [no description available] | low | 0 | 0 | monoterpenoid indole alkaloid; organic heteropentacyclic compound; secondary amino compound; tertiary amino compound | kappa-opioid receptor agonist; NMDA receptor antagonist; psychotropic drug; serotonin uptake inhibitor |
rescinnamine | [no description available] | low | 0 | 0 | indole alkaloid; methyl ester; organic heteropentacyclic compound | antihypertensive agent |
geissospermine | [no description available] | low | 0 | 0 | indole alkaloid; methyl ester; organic heteropentacyclic compound; organic heterotetracyclic compound | EC 3.1.1.7 (acetylcholinesterase) inhibitor |
hydrocodone | [no description available] | low | 0 | 0 | morphinane-like compound; organic heteropentacyclic compound | antitussive; mu-opioid receptor agonist; opioid analgesic |
hydromorphone | [no description available] | low | 0 | 0 | morphinane alkaloid; organic heteropentacyclic compound | mu-opioid receptor agonist; opioid analgesic |
nalbuphine | [no description available] | low | 0 | 0 | organic heteropentacyclic compound | mu-opioid receptor antagonist; opioid analgesic |
pholcodine | [no description available] | low | 0 | 0 | morphinane alkaloid; organic heteropentacyclic compound | antitussive; drug allergen; mu-opioid receptor agonist; opioid analgesic |
vinorelbine | [no description available] | low | 0 | 0 | acetate ester; methyl ester; organic heteropentacyclic compound; organic heterotetracyclic compound; ring assembly; vinca alkaloid | antineoplastic agent; photosensitizing agent |
oridonin | [no description available] | low | 0 | 0 | cyclic hemiketal; enone; ent-kaurane diterpenoid; organic heteropentacyclic compound; secondary alcohol | angiogenesis inhibitor; anti-asthmatic agent; antibacterial agent; antineoplastic agent; apoptosis inducer; plant metabolite |
thebaine | [no description available] | low | 0 | 0 | morphinane alkaloid; organic heteropentacyclic compound | |
catharanthine | [no description available] | low | 0 | 0 | alkaloid ester; bridged compound; methyl ester; monoterpenoid indole alkaloid; organic heteropentacyclic compound; tertiary amino compound | |
oripavine | [no description available] | low | 0 | 0 | ether; morphinane alkaloid; organic heteropentacyclic compound; organic hydroxy compound; tertiary amino compound | bacterial xenobiotic metabolite; opioid analgesic |
neopine | [no description available] | low | 0 | 0 | morphinane alkaloid; organic heteropentacyclic compound | |
resiniferatoxin | [no description available] | low | 0 | 0 | carboxylic ester; diterpenoid; enone; monomethoxybenzene; organic heteropentacyclic compound; ortho ester; phenols; tertiary alpha-hydroxy ketone | analgesic; neurotoxin; plant metabolite; TRPV1 agonist |
coronardine | [no description available] | low | 0 | 0 | alkaloid ester; methyl ester; monoterpenoid indole alkaloid; organic heteropentacyclic compound | antileishmanial agent; antineoplastic agent; apoptosis inducer; plant metabolite |
salannin | [no description available] | low | 0 | 0 | acetate ester; furans; limonoid; methyl ester; organic heteropentacyclic compound | antifeedant; insect growth regulator; plant metabolite |
muromonab-cd3 | [no description available] | low | 0 | 0 | alkaloid; macrocycle; organic heteropentacyclic compound; organonitrogen heterocyclic compound; oxacycle; tertiary amino compound | antineoplastic agent; EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor; IP3 receptor antagonist; marine metabolite |
akuammicine | [no description available] | low | 0 | 0 | methyl ester; monoterpenoid indole alkaloid; organic heteropentacyclic compound; tertiary amino compound | plant metabolite |
demethoxyfumitremorgin c | [no description available] | low | 0 | 0 | indole alkaloid; organic heteropentacyclic compound | mycotoxin |
eckstolonol | [no description available] | low | 0 | 0 | organic heteropentacyclic compound; oxacycle; phlorotannin | metabolite; radical scavenger |
vinflunine | [no description available] | low | 0 | 0 | acetate ester; methyl ester; organic heteropentacyclic compound; organic heterotetracyclic compound; semisynthetic derivative; vinca alkaloid | antineoplastic agent |
homocamptothecin | [no description available] | low | 0 | 0 | epsilon-lactone; organic heteropentacyclic compound; organonitrogen heterocyclic compound; tertiary alcohol | antineoplastic agent; EC 5.99.1.2 (DNA topoisomerase) inhibitor |
triphosphate | [no description available] | low | 0 | 0 | aldehyde; indole alkaloid; organic heteropentacyclic compound | plant metabolite |
gedunin | [no description available] | low | 0 | 0 | acetate ester; enone; epoxide; furans; lactone; limonoid; organic heteropentacyclic compound; pentacyclic triterpenoid | antimalarial; antineoplastic agent; Hsp90 inhibitor; plant metabolite |
simalikalactone D | [no description available] | low | 0 | 0 | cyclic ether; delta-lactone; enone; organic heteropentacyclic compound; quassinoid; secondary alcohol; secondary alpha-hydroxy ketone; triol | antimalarial; antineoplastic agent; antiviral agent; metabolite |
interiotherin b | [no description available] | low | 0 | 0 | aromatic ether; fatty acid ester; lignan; organic heteropentacyclic compound; oxacycle | anti-HIV agent; metabolite |
vindolinine | [no description available] | low | 0 | 0 | methyl ester; monoterpenoid indole alkaloid; organic heteropentacyclic compound; tertiary amino compound | plant metabolite |
alexa fluor 546 | [no description available] | low | 0 | 0 | organic heteropentacyclic compound | fluorochrome |
jadomycin b | [no description available] | low | 0 | 0 | glycoside; jadomycin; organic heteropentacyclic compound | antibacterial agent; antineoplastic agent; apoptosis inducer; Aurora kinase inhibitor; bacterial metabolite |
picrinine | [no description available] | low | 0 | 0 | alkaloid ester; indole alkaloid; methyl ester; organic heteropentacyclic compound; polycyclic ether | analgesic; anti-asthmatic agent; anti-inflammatory agent; antitussive; plant metabolite |
eurycomanone | [no description available] | low | 0 | 0 | cyclic ether; delta-lactone; enone; organic heteropentacyclic compound; pentol; quassinoid; secondary alcohol; secondary alpha-hydroxy ketone; tertiary alcohol | antimalarial; antineoplastic agent; metabolite |
crambescidin 800 | [no description available] | low | 0 | 0 | alkaloid; carboxylic ester; guanidines; monocarboxylic acid amide; organic heteropentacyclic compound; primary amino compound; secondary alcohol; spiro compound | anti-HIV-1 agent; anti-HSV-1 agent; antimalarial; marine metabolite |
naloxegol | [no description available] | low | 0 | 0 | aromatic ether; organic heteropentacyclic compound; phenols; polyether; tertiary alcohol | cathartic; mu-opioid receptor antagonist |
gs-5816 | [no description available] | low | 0 | 0 | carbamate ester; ether; imidazoles; L-valine derivative; N-acylpyrrolidine; organic heteropentacyclic compound; ring assembly | antiviral drug; hepatitis C virus nonstructural protein 5A inhibitor |
ebc-46 | [no description available] | low | 0 | 0 | diester; diterpenoid; organic heteropentacyclic compound; phorbol ester | antineoplastic agent; plant metabolite; protein kinase C agonist |
chrodrimanin b | [no description available] | low | 0 | 0 | organic heteropentacyclic compound | |
wilforgine | [no description available] | low | 0 | 0 | acetate ester; dihydroagarofuran sesquiterpenoid; furans; macrocyclic lactone; organic heteropentacyclic compound; pyridine alkaloid | plant metabolite |