2-[(4-hydroxy-3-nitrophenyl)sulfonylamino]benzoic acid [2-(4-methoxyphenyl)-2-oxoethyl] ester : no description available [CHeBI]
| Assay ID | Title | Year | Journal | Article |
|---|
| AID651635 | Viability Counterscreen for Primary qHTS for Inhibitors of ATXN expression | 2022 | The Journal of biological chemistry, 08, Volume: 298, Issue:8
ISSN: 1083-351X | |
| AID504810 | Antagonists of the Thyroid Stimulating Hormone Receptor: HTS campaign | 2010 | Endocrinology, Jul, Volume: 151, Issue:7
ISSN: 1945-7170 | A small molecule inverse agonist for the human thyroid-stimulating hormone receptor. |
| AID588499 | High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain A protease, MLPCN compound set | 2010 | Current protocols in cytometry, Oct, Volume: Chapter 13ISSN: 1934-9300 | Microsphere-based flow cytometry protease assays for use in protease activity detection and high-throughput screening. |
| AID588499 | High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain A protease, MLPCN compound set | 2006 | Cytometry. Part A : the journal of the International Society for Analytical Cytology, May, Volume: 69, Issue:5
ISSN: 1552-4922 | Microsphere-based protease assays and screening application for lethal factor and factor Xa. |
| AID588499 | High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain A protease, MLPCN compound set | 2010 | Assay and drug development technologies, Feb, Volume: 8, Issue:1
ISSN: 1557-8127 | High-throughput multiplex flow cytometry screening for botulinum neurotoxin type a light chain protease inhibitors. |
| AID588497 | High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain F protease, MLPCN compound set | 2010 | Current protocols in cytometry, Oct, Volume: Chapter 13ISSN: 1934-9300 | Microsphere-based flow cytometry protease assays for use in protease activity detection and high-throughput screening. |
| AID588497 | High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain F protease, MLPCN compound set | 2006 | Cytometry. Part A : the journal of the International Society for Analytical Cytology, May, Volume: 69, Issue:5
ISSN: 1552-4922 | Microsphere-based protease assays and screening application for lethal factor and factor Xa. |
| AID588497 | High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Botulinum neurotoxin light chain F protease, MLPCN compound set | 2010 | Assay and drug development technologies, Feb, Volume: 8, Issue:1
ISSN: 1557-8127 | High-throughput multiplex flow cytometry screening for botulinum neurotoxin type a light chain protease inhibitors. |
| AID1745845 | Primary qHTS for Inhibitors of ATXN expression | 2022 | The Journal of biological chemistry, 08, Volume: 298, Issue:8
ISSN: 1083-351X | |
| AID588501 | High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Lethal Factor Protease, MLPCN compound set | 2010 | Current protocols in cytometry, Oct, Volume: Chapter 13ISSN: 1934-9300 | Microsphere-based flow cytometry protease assays for use in protease activity detection and high-throughput screening. |
| AID588501 | High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Lethal Factor Protease, MLPCN compound set | 2006 | Cytometry. Part A : the journal of the International Society for Analytical Cytology, May, Volume: 69, Issue:5
ISSN: 1552-4922 | Microsphere-based protease assays and screening application for lethal factor and factor Xa. |
| AID588501 | High-throughput multiplex microsphere screening for inhibitors of toxin protease, specifically Lethal Factor Protease, MLPCN compound set | 2010 | Assay and drug development technologies, Feb, Volume: 8, Issue:1
ISSN: 1557-8127 | High-throughput multiplex flow cytometry screening for botulinum neurotoxin type a light chain protease inhibitors. |
| AID504812 | Inverse Agonists of the Thyroid Stimulating Hormone Receptor: HTS campaign | 2010 | Endocrinology, Jul, Volume: 151, Issue:7
ISSN: 1945-7170 | A small molecule inverse agonist for the human thyroid-stimulating hormone receptor. |
| Substance | Studies | Classes | Roles | First Year | Last Year | Average Age | Relationship Strength | Trials | pre-1990 | 1990's | 2000's | 2010's | post-2020 |
|---|
| oxoamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-oxo-4-(3-pyridyl)butanoic acid | | aromatic ketone;
monocarboxylic acid;
pyridines | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| bupropion | | aromatic ketone;
monochlorobenzenes;
secondary amino compound | antidepressant;
environmental contaminant;
xenobiotic | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| bw 306u | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| kynurenine | | aromatic ketone;
non-proteinogenic alpha-amino acid;
substituted aniline | human metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| monomethylpropion | | aromatic ketone;
secondary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| ro 48-8071 | | aromatic ether;
aromatic ketone;
bromobenzenes;
monofluorobenzenes;
olefinic compound;
tertiary amino compound | antineoplastic agent;
EC 5.4.99.7 (lanosterol synthase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| amiodarone | | 1-benzofurans;
aromatic ketone;
organoiodine compound;
tertiary amino compound | cardiovascular drug | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| anisindione | | aromatic ketone;
beta-diketone | anticoagulant;
vitamin K antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| acetovanillone | | 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 | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| benzbromarone | | 1-benzofurans;
aromatic ketone | uricosuric drug | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| bromperidol | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| buflomedil | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| celiprolol | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| droperidol | | aromatic ketone;
benzimidazoles;
organofluorine compound | anaesthesia adjuvant;
antiemetic;
dopaminergic antagonist;
first generation antipsychotic | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| dyclonine | | aromatic ketone;
piperidines | topical anaesthetic | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| eperisone | | aromatic ketone;
piperidines | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| eprazinone | | aromatic ketone;
ether;
N-alkylpiperazine | mucolytic | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| ethacrynic acid | | aromatic ether;
aromatic ketone;
dichlorobenzene;
monocarboxylic acid | EC 2.5.1.18 (glutathione transferase) inhibitor;
ion transport inhibitor;
loop diuretic | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| haloperidol | | aromatic ketone;
hydroxypiperidine;
monochlorobenzenes;
organofluorine compound;
tertiary alcohol | antidyskinesia agent;
antiemetic;
dopaminergic antagonist;
first generation antipsychotic;
serotonergic antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| ketanserin | | aromatic ketone;
organofluorine compound;
piperidines;
quinazolines | alpha-adrenergic antagonist;
antihypertensive agent;
cardiovascular drug;
EC 3.4.21.26 (prolyl oligopeptidase) inhibitor;
serotonergic antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| ketorolac | | amino acid;
aromatic ketone;
monocarboxylic acid;
pyrrolizines;
racemate | analgesic;
cyclooxygenase 1 inhibitor;
cyclooxygenase 2 inhibitor;
non-steroidal anti-inflammatory drug | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| lofepramine | | aromatic ketone;
dibenzoazepine;
monochlorobenzenes;
tertiary amino compound | antidepressant | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| mebendazole | | aromatic ketone;
benzimidazoles;
carbamate ester | antinematodal drug;
microtubule-destabilising agent;
tubulin modulator | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| nocodazole | | aromatic ketone;
benzimidazoles;
carbamate ester;
thiophenes | antimitotic;
antineoplastic agent;
microtubule-destabilising agent;
tubulin modulator | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| metyrapone | | aromatic ketone | antimetabolite;
diagnostic agent;
EC 1.14.15.4 (steroid 11beta-monooxygenase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| moperone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| phenindione | | aromatic ketone;
beta-diketone | anticoagulant | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| pifithrin | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| pipamperone | | aromatic ketone;
bipiperidines;
monocarboxylic acid amide;
organofluorine compound;
tertiary amino compound | dopaminergic antagonist;
first generation antipsychotic;
serotonergic antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| pirenperone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| propafenone | | aromatic ketone;
secondary alcohol;
secondary amino compound | anti-arrhythmia drug | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| propiomazine | | aromatic ketone;
phenothiazines;
tertiary amino compound | dopaminergic antagonist;
histamine antagonist;
muscarinic antagonist;
phenothiazine antipsychotic drug;
sedative;
serotonergic antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| raloxifene | | 1-benzothiophenes;
aromatic ketone;
N-oxyethylpiperidine;
phenols | bone density conservation agent;
estrogen antagonist;
estrogen receptor modulator | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| spiperone | | aromatic ketone;
azaspiro compound;
organofluorine compound;
piperidines;
tertiary amino compound | alpha-adrenergic antagonist;
antipsychotic agent;
dopaminergic antagonist;
psychotropic drug;
serotonergic antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| suprofen | | 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 | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| tiaprofenic acid | | aromatic ketone;
monocarboxylic acid;
thiophenes | drug allergen;
non-steroidal anti-inflammatory drug | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| tolmetin | | aromatic ketone;
monocarboxylic acid;
pyrroles | EC 1.14.99.1 (prostaglandin-endoperoxide synthase) inhibitor;
non-steroidal anti-inflammatory drug | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| tolperisone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| trifluperidol | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| zomepirac | | aromatic ketone;
monocarboxylic acid;
monochlorobenzenes;
pyrroles | cardiovascular drug;
non-steroidal anti-inflammatory drug | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| acepromazine | | aromatic ketone;
methyl ketone;
phenothiazines;
tertiary amino compound | phenothiazine antipsychotic drug | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| benziodarone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| musk ketone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| quinophthalone | | aromatic ketone;
beta-diketone;
quinolines | dye | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-acetylthiophene | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| diethylpropion | | aromatic ketone;
tertiary amine | appetite depressant | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| adrenalone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| dibenzoylmethane | | aromatic ketone;
beta-diketone | antimutagen;
antineoplastic agent;
metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| pyrazolanthrone | | anthrapyrazole;
aromatic ketone;
cyclic ketone | antineoplastic agent;
c-Jun N-terminal kinase inhibitor;
geroprotector | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| benzil | | alpha-diketone;
aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4'-(chloroacetyl)acetanilide | | acetamides;
alpha-chloroketone;
aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-acetylpyridine | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| ninhydrin | | aromatic ketone;
beta-diketone;
indanones;
ketone hydrate | colour indicator;
human metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| capillin | | aromatic ketone;
ynone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| gallacetophenone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-phenyl-1,2-propanedione | | alpha-diketone;
aromatic ketone | plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1,3-indandione | | aromatic ketone;
beta-diketone;
indanones | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| phenacylamine | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-acetylpyrrole | | aromatic ketone;
methyl ketone;
pyrroles | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-acetylpyridine | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| pyrovalerone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-acetylfuran | | aromatic ketone;
furans;
methyl ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| sapropterin | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| fluanisone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-Acetyl-2,4-dimethylpyrrole | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| metylperon | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| azaperone | | aminopyridine;
aromatic ketone;
monofluorobenzenes;
N-alkylpiperazine;
N-arylpiperazine;
tertiary amino compound | antipsychotic agent;
dopaminergic antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| Propioveratrone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| benperidol | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2,4-diacetylphloroglucinol | | aromatic ketone;
benzenetriol;
diketone;
methyl ketone | antifungal agent;
bacterial metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-benzoylpyridine | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| pyoluteorin | | aromatic ketone;
beta-hydroxy ketone;
diol;
organochlorine compound;
organochlorine pesticide;
polyketide;
pyrroles;
resorcinols | antibacterial agent;
antifungal agent;
apoptosis inducer;
bacterial metabolite;
marine metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| flubendazole | | aromatic ketone;
benzimidazoles;
carbamate ester;
organofluorine compound | antinematodal drug;
teratogenic agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-ipomeanol | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| ticrynafen | | aromatic ether;
aromatic ketone;
dichlorobenzene;
monocarboxylic acid;
thiophenes | antihypertensive agent;
hepatotoxic agent;
loop diuretic | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| celiprolol hydrochloride | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3,4-dihydroxyphenyl)-2-(1-imidazolyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| enoximone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| bupropion hydrochloride | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-oxo-3-phenylpropanenitrile | | aromatic ketone;
beta-ketonitrile | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| fenofibric acid | | aromatic ketone;
chlorobenzophenone;
monocarboxylic acid | drug metabolite;
marine xenobiotic metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| inaperisone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| valerophenone | | aromatic ketone | plant metabolite;
volatile oil component | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2,4,6-trihydroxyacetophenone | | aromatic ketone;
benzenetriol;
methyl ketone | MALDI matrix material;
plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| perilla ketone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| butofilolol | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2,6-dihydroxyacetophenone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2',4'-Dimethoxypropiophenone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| propipocaine | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| hp 873 | | 1,2-benzoxazoles;
aromatic ether;
aromatic ketone;
methyl ketone;
monoamine;
organofluorine compound;
piperidines;
tertiary amino compound | dopaminergic antagonist;
second generation antipsychotic;
serotonergic antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| prifelone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| metamfepramone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(2,4-dihydroxyphenyl)-1-hexanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(2,4-Dihydroxyphenyl)-1-butanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| isoxaflutole | | (trifluoromethyl)benzenes;
aromatic ketone;
cyclopropanes;
isoxazoles;
sulfone | agrochemical;
EC 1.13.11.27 (4-hydroxyphenylpyruvate dioxygenase) inhibitor;
proherbicide | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| sulcotrione | | aromatic ketone;
beta-triketone;
cyclohexanones;
sulfone | carotenoid biosynthesis inhibitor;
environmental contaminant;
herbicide;
xenobiotic | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| tolperisone hydrochloride | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| beta-(4-fluorobenzoyl)propionic acid | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| lobeline | | aromatic ketone;
piperidine alkaloid;
tertiary amine | nicotinic acetylcholine receptor agonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| aflatoxin q1 | | aflatoxin;
aromatic ether;
aromatic ketone | carcinogenic agent;
human xenobiotic metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| desethylamiodarone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| ly 117018 | | 1-benzothiophenes;
aromatic ketone;
N-alkylpyrrolidine;
phenols | bone density conservation agent;
estrogen receptor antagonist;
estrogen receptor modulator | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| fpl 55712 | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (6R)-7-[4-(dimethylamino)phenyl]-N-hydroxy-4,6-dimethyl-7-oxohepta-2,4-dienamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-hydoxy-1-(3-pyridyl)-1-butanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[4-[2-hydroxy-3-[4-[3-(trifluoromethyl)phenyl]-1-piperazinyl]propoxy]phenyl]-1-propanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-(1-piperidinyl)-1-(4-propan-2-yloxyphenyl)-1-propanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-n-methylspiperone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| ly 255283 | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| eperisone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| n-(4-aminophenethyl)spiroperidol | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| esonarimod | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| oxoline | | aromatic ketone;
tetralins | geroprotector | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| n-acetyl-n-formyl-5-methoxykynurenamine | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4(4-chlorophenyl)-1-(4-(4-fluorophenyl)-4-oxobutyl)-1,2,3,6-tetrahydropyridine | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| mesotrione | | aromatic ketone;
beta-triketone;
C-nitro compound;
sulfone | carotenoid biosynthesis inhibitor;
EC 1.13.11.27 (4-hydroxyphenylpyruvate dioxygenase) inhibitor;
environmental contaminant;
herbicide;
xenobiotic | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| rs 67333 | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| aflatoxin b1 | | aflatoxin;
aromatic ether;
aromatic ketone | carcinogenic agent;
human metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| dronedarone | | 1-benzofurans;
aromatic ether;
aromatic ketone;
sulfonamide;
tertiary amino compound | anti-arrhythmia drug;
environmental contaminant;
xenobiotic | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| alpha-pyrrolidinopropiophenone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (1-tert-butyl-5-phenyl-3-pyrrolyl)-phenylmethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| veratrone | | aromatic ketone;
dimethoxybenzene;
primary alcohol | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 7-benzoyl-3-chloroindolizine-1,2-dicarboxylic acid dimethyl ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| bromodeoxytopsentin | | aromatic ketone;
bromoindole;
imidazoles;
indole alkaloid | antibacterial agent;
EC 2.7.1.40 (pyruvate kinase) inhibitor;
marine metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| amiodarone hydrochloride | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| knipholone | | aromatic ketone;
dihydroxyanthraquinone;
methoxybenzenes;
methyl ketone;
polyphenol;
resorcinols | antineoplastic agent;
antioxidant;
antiplasmodial drug;
leukotriene antagonist;
metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| alpha bitter acid | | aromatic ketone;
cyclic ketone;
diketone;
tertiary alpha-hydroxy ketone;
triol | antibacterial drug;
antioxidant;
cyclooxygenase 2 inhibitor;
metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-Acetylthiazole | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[3-acetyl-5-[(4-bromophenyl)-oxomethyl]-1,3,7-triazabicyclo[3.3.1]nonan-7-yl]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| LSM-42773 | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(4-methylphenyl)-2-(1H-1,2,4-triazol-5-ylthio)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-(4-fluoroanilino)-1-(3-nitrophenyl)-1-propanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (5-methoxy-3-benzofuranyl)-phenylmethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-Hydroxy-1-(4-hydroxyphenyl)-1-propanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (2-amino-5-methyl-3-thiophenyl)-thiophen-2-ylmethanone | | aromatic ketone;
thiophenes | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(2,5-dimethoxyphenyl)-2-[[5-(2-furanyl)-4-propyl-1,2,4-triazol-3-yl]thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(1,3-benzodioxol-5-ylmethyl)-3-hydroxy-3-[2-(4-methylphenyl)-2-oxoethyl]-2-indolone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[(5-amino-1-phenacyl-1,2,4-triazol-3-yl)thio]-N-(3-cyano-4,5-dimethyl-2-thiophenyl)acetamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[[1-(2-methoxyethyl)-5-tetrazolyl]thio]-1-phenylethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(4-methoxyphenyl)-2-(5-thiophen-2-yl-2-tetrazolyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3-methoxyphenyl)-2-[[4-methyl-5-[[(4-phenyl-2-thiazolyl)amino]methyl]-1,2,4-triazol-3-yl]thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(5-chloro-2-methoxyphenyl)-2-[(4,6-diamino-2-pyrimidinyl)thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[(5-methyl-1H-1,2,4-triazol-3-yl)thio]-1-phenylethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(4-chlorophenyl)-2-[[4-ethyl-5-(2-methyl-3-furanyl)-1,2,4-triazol-3-yl]thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3,4-dichlorophenyl)-2-[[4-(2-furanylmethyl)-5-(3-pyridinyl)-1,2,4-triazol-3-yl]thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (4-chloro-5-hydroxy-3-benzofuranyl)-phenylmethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-(3-benzoyl-6-chloro-4,5-dihydroxy-7-benzofuranyl)pentane-2,4-dione | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3,4-dihydroxyphenyl)-2-[[5-(2-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(4-fluorophenyl)-2-[[4-(2-furanylmethyl)-5-(phenoxymethyl)-1,2,4-triazol-3-yl]thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-(4-acetylphenyl)-2-thiophen-2-ylacetamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-thiomorpholinecarbodithioic acid [2-(4-chlorophenyl)-2-oxoethyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[4-[(2-methyl-4-quinolinyl)amino]phenyl]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3,4-dihydroxyphenyl)-2-[(4,6-dimethyl-2-pyrimidinyl)thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(4-Chlorophenyl)-2-[(1-methyl-1H-imidazol-2-yl)thio]ethan-1-one | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-(4-ethoxyphenyl)-4-oxobutanoic acid | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-bromo-N-phenacylbenzamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N1-[2-(4-chlorophenyl)-2-oxoethyl]-4-chlorobenzamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[4-[(4,6-dimethyl-2-pyrimidinyl)amino]phenyl]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-amino-2-(phenacylthio)-5-pyrimidinecarboxylic acid ethyl ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (3-hydroxy-5,6,7,8-tetrahydro-4H-cyclohepta[d]imidazol-2-yl)-phenylmethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-fluoro-N-phenacylbenzamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-(Benzotriazol-1-yl)-1-(4-bromophenyl)ethanone | | aromatic ketone | anticoronaviral agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-(4-methylanilino)-1-(4-nitrophenyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3-((2',4'-Dimethyl-[4,5'-bithiazol]-2-yl)amino)phenyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[4-(1-azepanyl)-3-fluorophenyl]-1-propanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-(8-quinolinylthio)acetic acid phenacyl ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-(4-ethoxyanilino)-1-(4-methylphenyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[4-[[6-methyl-2-(methylthio)-5-prop-2-enyl-4-pyrimidinyl]amino]phenyl]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (4-methoxyphenyl)-(3-methyl-2-propyl-4-imidazolyl)methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 5-[(5-acetyl-2-propan-2-yloxyphenyl)methyl]-6-hydroxy-2-sulfanylidene-1H-pyrimidin-4-one | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-(5-benzoyl-4-phenyl-2-thiazolyl)carbamic acid methyl ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-chloro-N-[5-ethyl-3-[(4-methylphenyl)-oxomethyl]-2-thiophenyl]acetamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(4-fluorophenyl)-2-(2-pyridinylthio)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-(3-acetylphenyl)-2-thiophen-2-ylacetamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-(4-bromoanilino)-1-(3-nitrophenyl)-1-propanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-anilino-1-(3-nitrophenyl)-1-propanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(5-ethyl-2,4-dihydroxyphenyl)-2-(2-fluorophenoxy)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-[1-(4-acetylphenyl)-5-thiophen-2-yl-2-pyrrolyl]propanoic acid | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (7-methoxy-2-benzofuranyl)-(4-nitrophenyl)methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-[2-(3-methoxyphenyl)-2-oxoethoxy]benzoic acid methyl ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-phenacyloxybenzoic acid methyl ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(2-hydroxyphenyl)-2-(2H-tetrazol-5-yl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-(methylamino)benzoic acid [2-(4-fluorophenyl)-2-oxoethyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[(4-methyl-2-pyrimidinyl)thio]-1-(3-nitrophenyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-[[(3-acetylanilino)-oxomethyl]amino]-2-thiophenecarboxylic acid methyl ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3-acetylphenyl)-3-(2-pyridinylmethyl)urea | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(4-acetylphenyl)-3-[2-(4-fluorophenyl)ethyl]thiourea | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-phenyl-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-tert-butyl-7-[[2-(4-methylphenyl)-2-oxoethyl]thio]-[1,3,4]thiadiazolo[2,3-c][1,2,4]triazin-4-one | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| LSM-4563 | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[4-[3-[5-(2-furanyl)-1H-pyrazol-3-yl]-5-sulfanylidene-1H-1,2,4-triazol-4-yl]phenyl]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1,3-diphenyl-4-pyrazolecarboxylic acid [2-(4-methyl-3-nitrophenyl)-2-oxoethyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| Silica aerogel | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[[5-(1-benzotriazolylmethyl)-4-methyl-1,2,4-triazol-3-yl]thio]-1-(2-fluorophenyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-(4-acetylphenyl)-2-[[1-(3,5-dimethoxyphenyl)-5-tetrazolyl]thio]acetamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3,4-dimethoxybenzoic acid [2-(3,4-dimethoxyphenyl)-2-oxoethyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[2-[2-(4-chlorophenyl)-2-oxoethoxy]phenyl]isoindole-1,3-dione | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[[5-(7-methoxy-2-benzofuranyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-1-(4-methoxyphenyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[[4,6-bis(1-piperidinyl)-1,3,5-triazin-2-yl]thio]-1-phenylethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(2,5-dimethylphenyl)-2-[(5-methyl-1,3,4-thiadiazol-2-yl)thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-methyl-1,5-dithiophen-2-ylpentane-1,5-dione | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3,4-dihydroxyphenyl)-2-[[5-(4-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[[5-(3-chlorophenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]-1-(3,4-dihydroxyphenyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3,4-dihydroxyphenyl)-2-[[5-(3-methylphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3,4-dihydroxyphenyl)-2-[[5-(4-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3,4-dihydroxyphenyl)-2-[[5-(3-methoxyphenyl)-4-prop-2-enyl-1,2,4-triazol-3-yl]thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (4-chlorophenyl)-(5-hydroxy-2-methyl-4,6-dinitro-3-benzofuranyl)methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3,4-dimethylphenyl)-2-[[5-[[2-(4-ethoxyanilino)-4-thiazolyl]methyl]-1,3,4-oxadiazol-2-yl]thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(4-fluorophenyl)-2-[(2-propyl-4-quinazolinyl)thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (5-chloro-2-hydroxyphenyl)-[2-ethyl-3-(4-fluorophenyl)-6-pyrazolo[1,5-a]pyrimidinyl]methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N,N-dimethylcarbamothioic acid O-[4-[2-[(4-chlorophenyl)thio]-1-oxoethyl]-2,6-dimethylphenyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-[(4-tert-butylphenyl)-oxomethyl]-N-[2-(2-pyridinyl)ethyl]-1H-pyrrole-2-carboxamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (4-chlorophenyl)-[5-(4-morpholinyl)-4-(2-pyridinyl)-2-thiophenyl]methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N,N-dimethylcarbamic acid [4-[2-(benzenesulfonyl)-1-oxoethyl]-2,6-dimethylphenyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N,N-dimethylcarbamic acid [4-[2-(4-fluorophenyl)sulfonyl-1-oxoethyl]-2,6-dimethylphenyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-chloro-1-[1-(2-furanylmethyl)-2,5-dimethyl-3-pyrrolyl]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-[(phenacylamino)-sulfanylidenemethyl]-2-furancarboxamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-phenylpropionylglycine | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-amino-5-[(4-methylphenyl)-oxomethyl]-2-(prop-2-enylamino)-3-thiophenecarbonitrile | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-amino-4-[[2-(4-bromophenyl)-2-oxoethyl]thio]-3-azaspiro[5.5]undeca-1,4-diene-1,5-dicarbonitrile | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[[4-ethyl-5-(thiophen-2-ylmethyl)-1,2,4-triazol-3-yl]thio]-1-(4-methylphenyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 7-amino-9-(phenacylthio)-8-azaspiro[4.5]deca-6,9-diene-6,10-dicarbonitrile | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 6-(bromomethyl)-1,3-dimethyl-5-[(4-nitrophenyl)-oxomethyl]pyrimidine-2,4-dione | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(2,4-dimethylphenyl)-2-([1,2,4]triazolo[4,3-a]pyridin-3-ylthio)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-(4-acetylphenoxy)butanoic acid [5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]methyl ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[[5-[(1,3-benzothiazol-2-ylthio)methyl]-4-ethyl-1,2,4-triazol-3-yl]thio]-1-(3,4-dihydroxyphenyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-chloro-1-[2,5-dimethyl-1-(5-methyl-3-isoxazolyl)-3-pyrrolyl]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[2-[[5-cyano-1-(3-methoxypropyl)-6-oxo-3-pyridinyl]-oxomethyl]-4-methoxyphenoxy]-N-(5-methyl-3-isoxazolyl)acetamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[2-[2,5-dimethyl-1-(phenylmethyl)-3-pyrrolyl]-2-oxoethyl]pyrrolidine-2,5-dione | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3,5-dimethyl-4-isoxazolecarboxylic acid [2-(4-amino-1-methyl-2,6-dioxo-3-propyl-5-pyrimidinyl)-2-oxoethyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[3-[(4-chlorophenyl)-oxomethyl]-6-methoxy-4-oxo-1-quinolinyl]-N-(4-fluorophenyl)acetamide | | aromatic ketone;
quinolines | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[4-[(2-amino-5-thiazolyl)methyl]phenyl]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| [9-(4-ethoxyphenyl)sulfonyl-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-8-yl]-(4-methylphenyl)methanone | | aromatic ketone;
quinolines | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-chloro-N-[(phenacylamino)-sulfanylidenemethyl]benzamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-[(phenacylamino)-sulfanylidenemethyl]cyclohexanecarboxamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-(4-chlorophenyl)-4-oxobutanoic acid [2-(2-furanylmethylamino)-2-oxoethyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(2-chlorophenyl)-2-(3,5-dimethyl-4-nitro-1-pyrazolyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| [5-(4-chlorophenyl)-1,3,4-oxadiazol-2-yl]-[4-(1-piperidinylsulfonyl)phenyl]methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-(dimethylamino)benzoic acid [2-(2-methoxyphenyl)-2-oxoethyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-chloro-3-pyridinecarboxylic acid [2-(4-fluorophenyl)-2-oxoethyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-(1,3-benzothiazol-2-yl)propanoic acid phenacyl ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 5-[(2-hydroxy-5-methylphenyl)-oxomethyl]-N,1-bis[2-(4-methoxyphenyl)ethyl]-2-oxo-3-pyridinecarboxamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[(1-oxido-2-pyridin-1-iumyl)thio]-1-(4-phenylphenyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-(1H-benzimidazol-2-yl)-1-(3-nitrophenyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[[2-oxo-2-[3-(trifluoromethyl)phenyl]ethyl]thio]-3-pyridinecarboxylic acid | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[[5-(2-furanyl)-1,3,4-oxadiazol-2-yl]thio]-1-(2-methoxyphenyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-chloro-1-[1-[2-(4-chlorophenyl)ethyl]-2,5-dimethyl-3-pyrrolyl]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-chloro-3-pyridinecarboxylic acid [2-(4-ethylphenyl)-2-oxoethyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-(4-acetylphenyl)-1-(phenylmethyl)-1-propylthiourea | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-anilinobenzoic acid [2-(4-acetylanilino)-2-oxoethyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-(2-acetylphenyl)-2-(2-oxo-1-quinoxalinyl)acetamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[[5-(5-bromo-2-furanyl)-4-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-1-(2-fluorophenyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4,5-dichloro-2-[2-[2,5-dimethyl-1-(2,2,2-trifluoroethyl)-3-pyrrolyl]-2-oxoethyl]-3-pyridazinone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 7-[(4-acetylphenoxy)methyl]-5-thiazolo[3,2-a]pyrimidinone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (3-amino-4,6-dimethyl-2-thieno[2,3-b]pyridinyl)-(2-chlorophenyl)methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[4-[(2-bromophenyl)-oxomethyl]-1H-pyrrol-2-yl]-2,2,2-trichloroethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-(4-hydroxy-1,3-thiazol-2-yl)-1-phenylethan-1-one | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-[1-(4-methyl-6-oxo-1-pyrimidinyl)-2-oxo-2-phenylethyl]benzamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-[5-ethyl-3-[(4-methoxyphenyl)-oxomethyl]-2-thiophenyl]-2-(4-methyl-1-piperazinyl)acetamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-[[5-ethyl-3-[(4-methoxyphenyl)-oxomethyl]-2-thiophenyl]amino]-4-oxobutanoic acid | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (2-anilino-4-methyl-1,3-thiazol-5-yl)(4-methoxyphenyl)methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (4-chlorophenyl)-[6,7-dichloro-4-[(dimethylamino)methyl]-5-hydroxy-2-methyl-3-benzofuranyl]methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| cid 2858522 | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3-nitrophenyl)-2-(1H-1,2,4-triazol-5-ylthio)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)thio]-1-phenylethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (3-amino-5-nitro-2-benzofuranyl)-phenylmethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-nitrobenzoic acid [1-(4-methylphenyl)-1-oxopropan-2-yl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-hydroxy-3-[2-oxo-2-[4-(1-pyrrolyl)phenyl]ethyl]-1H-indol-2-one | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[4-[3-[4-(4-fluorophenyl)-1-piperazinyl]-2-hydroxypropoxy]phenyl]-1-propanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[4-[4-[[6-bromo-2-(3-pyridinyl)-4-quinolinyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-[4-[(3-acetylphenyl)sulfamoyl]phenyl]-1-piperidinecarboxamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (2,5-dimethylphenyl)-(6-methyl-5-imidazo[2,1-b]thiazolyl)methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-hydroxy-1-adamantanecarboxylic acid [2-[1-(2-methoxyethyl)-2,5-dimethyl-3-pyrrolyl]-2-oxoethyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| [2-[(2,6-dimethyl-4-morpholinyl)-oxomethyl]phenyl]-(1H-imidazol-2-yl)methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-(2-furanyl)-3-oxo-2-(2-pyridinyl)propanenitrile | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[4-ethoxy-3-[[[4-(2-oxolanylmethyl)-5-thiophen-2-yl-1,2,4-triazol-3-yl]thio]methyl]phenyl]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| timiperone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| adefovir | | aromatic ether;
aromatic ketone;
biaryl;
cyclic ketone;
naphtho-gamma-pyrone;
organooxygen heterocyclic antibiotic;
polyphenol | antimalarial;
Aspergillus metabolite;
marine metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| phenyl-(2-thiophen-2-yl-5,10b-dihydro-1H-pyrazolo[1,5-c][1,3]benzoxazin-5-yl)methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-[3-[(4-chlorophenyl)-oxomethyl]-4,5,6,7-tetrahydro-1-benzothiophen-2-yl]-3-pyridinecarboxamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3,4-dihydroxyphenyl)-2-[(4-methyl-1,2,4-triazol-3-yl)thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-quinolinecarboxylic acid (1-oxo-1-phenylpropan-2-yl) ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-(3-acetylphenyl)-3-(1-ethyl-3-methyl-4-pyrazolyl)-4,5-dihydroisoxazole-5-carboxamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[4-[4-[[1-(4-chlorophenyl)sulfonylcyclopropyl]-oxomethyl]-1-piperazinyl]phenyl]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[2-(4-bromophenyl)-2-oxoethyl]-3-(2-furanylmethyl)-6,7-dimethoxyquinazoline-2,4-dione | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-(3-acetylphenyl)-3,5-dimethyl-4-isoxazolesulfonamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-[4-[2-(3,4-dimethoxyphenyl)-2-oxoethyl]-3-oxo-[1,2,4]triazino[2,3-a]benzimidazol-2-yl]propanoic acid | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-[(3-fluorophenyl)methyl]-8-[4-(4-fluorophenyl)-4-oxobutyl]-1-phenyl-1,3,8-triazaspiro[4.5]decan-4-one | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-[(4-acetyl-2-methoxyphenyl)methoxy]-3-methoxybenzoic acid [1-(carbamoylamino)-1-oxopropan-2-yl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-(2-chloro-3-pyridinyl)-3-oxo-3-phenylpropanamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 5-[2-(4-bromophenyl)-2-oxoethyl]-1,3-diphenyl-2-sulfanylidene-4-imidazolidinone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-(thiophen-2-ylsulfonylamino)benzoic acid [2-(3-acetylanilino)-2-oxo-1-phenylethyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-(4-chlorophenyl)-N-[3-[(4-methoxyphenyl)sulfamoyl]phenyl]-4-oxobutanamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[4-[oxo(thiophen-2-yl)methyl]phenyl]propanoic acid methyl ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-[3-[(3-chlorophenyl)sulfamoyl]-4-methylphenyl]-3-(4-nitrophenyl)-3-oxopropanamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| rs 102221 | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-[2-[[2-(4-chlorophenyl)-2-oxoethyl]thio]-4-oxo-3-quinazolinyl]benzamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-methyl-2-methylene-1,5-diphenylpentane-1,5-dione | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[1-(2-methylphenyl)-3-oxo-3-thiophen-2-ylpropyl]propanedinitrile | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (4-chlorophenyl)-(7-methyl-3-imidazo[1,2-a]pyridinyl)methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-benzoyl-2-heptyl-5-methyl-4H-pyrazol-3-one | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (4-benzoyl-1-methyl-3-pyrrolidinyl)-phenylmethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 6-benzoyl-2-phenyl-5-(trifluoromethyl)-3-pyridazinone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| LY-310762 | | aromatic ketone;
monofluorobenzenes;
oxindoles;
piperidines;
tertiary amino compound | receptor modulator;
serotonergic antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(4-methylphenyl)-2-[(1-phenyl-2-imidazolyl)thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| gr 103691 | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-(1,3-dioxo-2-benzo[de]isoquinolinyl)butanoic acid [2-(2-acetylanilino)-2-oxoethyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-chloro-N-(2,6-dimethylphenyl)-3-oxo-3-phenylpropanamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(4-chlorophenyl)-2-[[3-(3-methylphenyl)-1,2,4-thiadiazol-5-yl]thio]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-(3-acetylphenyl)-2-[[6-chloro-3-(2-hydroxypropyl)-4-methyl-2-oxo-1-benzopyran-7-yl]oxy]acetamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-[4-(4-acetylphenyl)-1-piperazinyl]-N-[3-(dimethylamino)propyl]-3-nitrobenzenesulfonamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-chloro-1-[1-(3-isoxazolyl)-2,5-dimethyl-3-pyrrolyl]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 5-[(5-bromo-2-hydroxyphenyl)-oxomethyl]-1-cyclohexyl-2-oxo-3-pyridinecarbonitrile | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[(5-ethyl-2-thiophenyl)-oxomethyl]benzoic acid | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-[4-(4-morpholinylsulfonyl)phenyl]propanoic acid [2-(4-acetylanilino)-2-oxoethyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| rottlerin | | aromatic ketone;
benzenetriol;
chromenol;
enone;
methyl ketone | anti-allergic agent;
antihypertensive agent;
antineoplastic agent;
apoptosis inducer;
K-ATP channel agonist;
metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| isoegomaketone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| palbociclib | | aminopyridine;
aromatic ketone;
cyclopentanes;
piperidines;
pyridopyrimidine;
secondary amino compound;
tertiary amino compound | antineoplastic agent;
EC 2.7.11.22 (cyclin-dependent kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| radicinin | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| oxyfedrine | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-(dimethylamino)-1-(5-methyl-3-phenyl-4-isoxazolyl)-2-propen-1-one | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-[[5,6-bis(2-furanyl)-1,2,4-triazin-3-yl]thio]-1-(4-methoxyphenyl)ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| buflomedil hydrochloride | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| ciproxifan | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4'-methyl-alpha-pyrrolidinopropiophenone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| l-165041 | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-(4-acetylphenyl)-2-[[3-(2-pyridinyl)-[1,2,4]triazolo[4,3-b]pyridazin-6-yl]thio]acetamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-[4-[[4-(4-acetylphenyl)-1-piperazinyl]sulfonyl]phenyl]acetamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 6-[[4-(4-acetylphenyl)-1-piperazinyl]sulfonyl]-3,4-dihydro-1H-quinolin-2-one | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-(2-benzoyl-1-pyrrolyl)-N-methyl-N-(phenylmethyl)acetamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| ic 86621 | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| scio-469 | | aromatic amide;
aromatic ketone;
chloroindole;
dicarboxylic acid diamide;
indolecarboxamide;
monofluorobenzenes;
N-acylpiperazine;
N-alkylpiperazine | antineoplastic agent;
apoptosis inducer;
EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| am 694 | | aromatic ketone;
indoles;
organofluorine compound;
organoiodine compound;
synthetic cannabinoid | cannabinoid receptor agonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| fonsecinone a | | aromatic ether;
aromatic ketone;
biaryl;
cyclic ketone;
naphtho-gamma-pyrone;
polyphenol | antibacterial agent;
Aspergillus metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| e 5555 | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| cytosporone b | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| benzobicyclon | | aromatic ketone;
carbobicyclic compound;
cyclic ketone;
monochlorobenzenes;
organic sulfide;
sulfone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| tembotrione | | aromatic ketone;
beta-triketone;
cyclic ketone;
ether;
monochlorobenzenes;
organofluorine compound;
sulfone | agrochemical;
carotenoid biosynthesis inhibitor;
EC 1.13.11.27 (4-hydroxyphenylpyruvate dioxygenase) inhibitor;
herbicide | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| y134 compound | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-[2-(3,4-dimethoxyphenyl)ethyl]-4-(4-ethoxyphenyl)-2,4-dioxobutanamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| [9-(benzenesulfonyl)-2,3-dihydro-[1,4]dioxino[2,3-g]quinolin-8-yl]-(4-methylphenyl)methanone | | aromatic ketone;
quinolines | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| alpha(-(cyclopropylcarbonyl)-2-(methyvlsulfonyl)-beta-oxo-4-(trifluromethyl)benzenepropanenitrile) | | (trifluoromethyl)benzenes;
aromatic ketone;
beta-diketone;
cyclopropanes;
nitrile;
sulfone | agrochemical;
EC 1.13.11.27 (4-hydroxyphenylpyruvate dioxygenase) inhibitor;
herbicide | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| aflatoxin m1 | | aflatoxin;
aromatic ether;
aromatic ketone;
tertiary alcohol | Aspergillus metabolite;
human xenobiotic metabolite;
mammalian metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| acetic acid [4-[[(3aS,4R,9aS,9bR)-2-(2-naphthalenyl)-1,3-dioxo-3a,4,9a,9b-tetrahydropyrrolo[1,2]pyrrolo[3,5-b]pyridazin-4-yl]-oxomethyl]phenyl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (3R,3aR,7aR)-3-[4-(4-acetylphenyl)-2-fluorophenyl]-7a-methyl-2-(phenylmethyl)-3,3a,6,7-tetrahydroisoindol-1-one | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (3-propan-2-yloxyphenyl)-[1-[(1-propan-2-yl-4-pyrazolyl)methyl]-3-piperidinyl]methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| [2-(methylthio)phenyl]-[1-[oxo(4-thiadiazolyl)methyl]-3-piperidinyl]methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-(3,5-dimethyl-1-pyrazolyl)-1-[3-[oxo-(3-propan-2-yloxyphenyl)methyl]-1-piperidinyl]ethanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| [1-[(5-methyl-1-propyl-4-pyrazolyl)methyl]-3-piperidinyl]-(3-propan-2-yloxyphenyl)methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| [1-[[1-(5-chloro-2-pyridinyl)-2-pyrrolyl]methyl]-3-piperidinyl]-(2,4-dimethoxyphenyl)methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 2-(2-acetyl-3,5-dihydroxyphenyl)acetic acid | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-(3,4-dihydroxyphenyl)-2-thiocyanate-ethanone | | aromatic ketone;
catechols;
thiocyanates | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (3R,3aS,7R,7aS)-3-[3-(4-acetylphenyl)-4-fluorophenyl]-7-methyl-2-(phenylmethyl)-3a,6,7,7a-tetrahydro-3H-isoindol-1-one | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-(3-acetylphenyl)-5-(3-methyl-5-isoxazolyl)-2-thiophenesulfonamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 5-[[4-(4-acetylphenyl)-1-piperazinyl]sulfonyl]-1,3-dihydroindol-2-one | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| plx 4720 | | aromatic ketone;
difluorobenzene;
organochlorine compound;
pyrrolopyridine;
sulfonamide | antineoplastic agent;
B-Raf inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| lcl161 | | 1,3-thiazoles;
aromatic ketone;
L-alanine derivative;
monofluorobenzenes;
N-acylpyrrolidine | antineoplastic agent;
apoptosis inducer | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| a-922500 | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| marinopyrrole a | | aromatic ketone;
organochlorine compound;
phenols;
pyrroles | antibacterial agent;
antimicrobial agent;
antineoplastic agent;
bacterial metabolite;
marine metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| plx4032 | | aromatic ketone;
difluorobenzene;
monochlorobenzenes;
pyrrolopyridine;
sulfonamide | antineoplastic agent;
B-Raf inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[2-[4-[(1-methyl-5-tetrazolyl)thio]-5-thieno[2,3-d]pyrimidinyl]phenyl]ethanone | | aromatic ketone;
thienopyrimidine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| cblc137 | | aromatic ketone;
carbazoles;
methyl ketone;
secondary amino compound;
tertiary amino compound | antineoplastic agent;
apoptosis inducer;
NF-kappaB inhibitor;
p53 activator | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| myrtucommulone a | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| (3,4-dimethoxyphenyl)-[1-(2-phenylethyl)-3-piperidinyl]methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| [1-(cyclohexylmethyl)-3-piperidinyl]-(3,4-dimethoxyphenyl)methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| yk 4-279 | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 1-[3-[4-[(1-methyl-5-tetrazolyl)thio]-5-thieno[2,3-d]pyrimidinyl]phenyl]ethanone | | aromatic ketone;
thienopyrimidine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 5-[[4-(4-acetylphenyl)-1-piperazinyl]sulfonyl]-3,3-dichloro-1H-indol-2-one | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| mephedrone | | amphetamines;
aromatic ketone;
secondary amino compound | environmental contaminant;
xenobiotic | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| alectinib | | aromatic ketone;
morpholines;
nitrile;
organic heterotetracyclic compound;
piperidines | antineoplastic agent;
EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 4-methylethcathinone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3,4-dimethylmethcathinone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| pogostone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| ilicicolin h | | aromatic ketone;
carbobicyclic compound;
ilicicolin;
monohydroxypyridine;
octahydronaphthalenes;
phenols;
pyridone | antimicrobial agent;
mitochondrial respiratory-chain inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| [4-amino-2-[2-methoxy-4-(4-methyl-1-piperazinyl)anilino]-5-thiazolyl]-(2,6-dichlorophenyl)methanone | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| biliatresone | | aromatic ether;
aromatic ketone;
benzodioxoles;
enone;
phenols | plant metabolite;
toxin | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| myxopyronin b | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| N-(4-acetylphenyl)-2-[(4-oxo-1H-quinazolin-2-yl)thio]butanamide | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 6-amino-2-[[2-(3,4-dimethylphenyl)-2-oxoethyl]thio]-1H-pyrimidin-4-one | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| 3-(4-oxo-1H-quinazolin-2-yl)propanoic acid [1-(4-bromophenyl)-1-oxopropan-2-yl] ester | | aromatic ketone | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
| nbi 31772 | | aromatic ketone;
benzenediols;
hydroxy monocarboxylic acid;
isoquinolines;
tetrol | insulin-like growth factor-binding protein inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |