8,5'-cyclo-2'-deoxyadenosine : An organic heterotetracyclic compound obtained by intramolecular formation of a C-C bond between positions 8 and 5' of 2'-deoxyadenosine. [CHeBI]
Substance | Studies | Classes | Roles | First Year | Last Year | Average Age | Relationship Strength | Trials | pre-1990 | 1990's | 2000's | 2010's | post-2020 |
aristolochic acid i | | aristolochic acids; aromatic ether; C-nitro compound; cyclic acetal; monocarboxylic acid; organic heterotetracyclic compound | carcinogenic agent; metabolite; mutagen; nephrotoxin; toxin | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
racemethorphan | | aromatic ether; morphinane alkaloid; morphinane-like compound; organic heterotetracyclic compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ellipticine | | indole alkaloid; organic heterotetracyclic compound; organonitrogen heterocyclic compound; polycyclic heteroarene | antineoplastic agent; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
lysergic acid diethylamide | | ergoline alkaloid; monocarboxylic acid amide; organic heterotetracyclic compound | dopamine agonist; hallucinogen; serotonergic agonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
vincristine | | 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 | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
gliotoxin | | dipeptide; organic disulfide; organic heterotetracyclic compound; pyrazinoindole | antifungal agent; EC 2.5.1.58 (protein farnesyltransferase) inhibitor; immunosuppressive agent; mycotoxin; proteasome inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
galantamine | | benzazepine alkaloid fundamental parent; benzazepine alkaloid; organic heterotetracyclic compound; tertiary amino compound | antidote to curare poisoning; cholinergic drug; EC 3.1.1.7 (acetylcholinesterase) inhibitor; EC 3.1.1.8 (cholinesterase) inhibitor; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
beta-erythroidine | | delta-lactone; indole alkaloid; organic heterotetracyclic compound; tertiary amino compound | muscle relaxant; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
hematoxylin | | organic heterotetracyclic compound; oxacycle; polyphenol; tertiary alcohol | histological dye; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
podophyllotoxin | | furonaphthodioxole; lignan; organic heterotetracyclic compound | antimitotic; antineoplastic agent; keratolytic drug; microtubule-destabilising agent; plant metabolite; tubulin modulator | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
quinacridone | | organic heterotetracyclic compound; organonitrogen heterocyclic compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
glaucine | | aporphine alkaloid; organic heterotetracyclic compound; polyether; tertiary amino compound | antibacterial agent; antineoplastic agent; antitussive; muscle relaxant; NF-kappaB inhibitor; plant metabolite; platelet aggregation inhibitor; rat metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
palmatine | | berberine alkaloid; organic heterotetracyclic compound | plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
dihydro-beta-erythroidine | | delta-lactone; organic heterotetracyclic compound; tertiary amino compound | nicotinic antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
nicergoline | | organic heterotetracyclic compound; organonitrogen heterocyclic compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
etoposide | | beta-D-glucoside; furonaphthodioxole; organic heterotetracyclic compound | antineoplastic agent; DNA synthesis inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
vindesine | | methyl ester; organic heteropentacyclic compound; organic heterotetracyclic compound; primary carboxamide; tertiary alcohol; tertiary amino compound; vinca alkaloid | antineoplastic agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pergolide | | diamine; methyl sulfide; organic heterotetracyclic compound | antiparkinson drug; dopamine agonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
calanolide a | | cyclic ether; delta-lactone; organic heterotetracyclic compound; secondary alcohol | HIV-1 reverse transcriptase inhibitor; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
nile red | | aromatic amine; cyclic ketone; organic heterotetracyclic compound; tertiary amino compound | fluorochrome; histological dye | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
tetrahydropalmatine | | an (S)-7,8,13,14-tetrahydroprotoberberine; berberine alkaloid; organic heterotetracyclic compound | adrenergic agent; dopaminergic antagonist; non-narcotic analgesic | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
columbamine | | berberine alkaloid; organic heterotetracyclic compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
picropodophyllin | | furonaphthodioxole; lignan; organic heterotetracyclic compound | antineoplastic agent; insulin-like growth factor receptor 1 antagonist; plant metabolite; tyrosine kinase inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
brazilin | | catechols; organic heterotetracyclic compound; tertiary alcohol | anti-inflammatory agent; antibacterial agent; antineoplastic agent; antioxidant; apoptosis inducer; biological pigment; hepatoprotective agent; histological dye; NF-kappaB inhibitor; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
tryptanthrine | | alkaloid antibiotic; organic heterotetracyclic compound; organonitrogen heterocyclic compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
cryptolepine | | indole alkaloid; organic heterotetracyclic compound; organonitrogen heterocyclic compound | anti-inflammatory agent; antimalarial; antineoplastic agent; cysteine protease inhibitor; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
9-hydroxyellipticine | | organic heterotetracyclic compound; organonitrogen heterocyclic compound | antineoplastic agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
beta-peltatin | | furonaphthodioxole; gamma-lactone; lignan; organic heterotetracyclic compound; phenols | antineoplastic agent; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
alpha-peltatin | | furonaphthodioxole; gamma-lactone; lignan; organic heterotetracyclic compound; phenols | antineoplastic agent; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
canthin-6-one | | enone; indole alkaloid; organic heterotetracyclic compound | antimycobacterial drug; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
allocryptopine | | aromatic ether; cyclic acetal; cyclic ketone; dibenzazecine alkaloid; organic heterotetracyclic compound; tertiary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
berbine | | berberine alkaloid; isoquinoline alkaloid fundamental parent; organic heterotetracyclic compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
aristolochic acid ii | | aristolochic acids; aromatic ether; C-nitro compound; cyclic acetal; monocarboxylic acid; organic heterotetracyclic compound | carcinogenic agent; metabolite; mutagen; nephrotoxin; toxin | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
megestrol acetate | | bridged compound; organic heterotetracyclic compound; secondary alcohol; sesquiterpene lactone; spiro compound; tertiary alcohol; tetrol | GABA antagonist; neurotoxin; phytogenic insecticide; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
4'-demethylpodophyllotoxin | | furonaphthodioxole; organic heterotetracyclic compound; phenols | metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
4'-demethylepipodophyllotoxin | | furonaphthodioxole; organic heterotetracyclic compound; phenols | antineoplastic agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
psorospermin | | epoxide; organic heterotetracyclic compound; xanthones | antineoplastic agent; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
asperlicin c | | asperlicins; indoles; organic heterotetracyclic compound | Aspergillus metabolite; cholecystokinin antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
schizandrin b | | aromatic ether; cyclic acetal; organic heterotetracyclic compound; oxacycle; tannin | anti-asthmatic agent; anti-inflammatory agent; antilipemic drug; antioxidant; apoptosis inhibitor; hepatoprotective agent; nephroprotective agent; neuroprotective agent; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
corytuberine | | aporphine alkaloid; aromatic ether; organic heterotetracyclic compound; polyphenol; tertiary amino compound | plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
5,6-didehydrosparteine | | organic heterotetracyclic compound; quinolizidine alkaloid; tertiary amino compound | human xenobiotic metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
aristolochic acid D | | aristolochic acids; aromatic ether; C-nitro compound; cyclic acetal; monocarboxylic acid; organic heterotetracyclic compound | carcinogenic agent; metabolite; nephrotoxin; toxin | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
stephenanthrine | | cyclic acetal; organic heterotetracyclic compound; tertiary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
aristolochic acid c | | aristolochic acids; aromatic ether; C-nitro compound; cyclic acetal; monocarboxylic acid; organic heterotetracyclic compound | carcinogenic agent; metabolite; mutagen; nephrotoxin; toxin | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
erysodine | | aromatic ether; diether; Erythrina alkaloid; organic heterotetracyclic compound; phenols | antiparasitic agent; nicotinic antagonist; phytogenic insecticide | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
top 53 | | furonaphthodioxole; gamma-lactone; organic heterotetracyclic compound; phenols; tertiary amino compound | antineoplastic agent; EC 5.99.1.3 [DNA topoisomerase (ATP-hydrolysing)] inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pronuciferine | | aromatic ether; cyclic ketone; isoquinoline alkaloid; isoquinolines; organic heterotetracyclic compound | plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
vincaleukoblastine | | 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 | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
5-methoxycanthin-6-one | | alkaloid; organic heterotetracyclic compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pd 146176 | | organic heterotetracyclic compound; organonitrogen heterocyclic compound; organosulfur heterocyclic compound | antiatherogenic agent; EC 1.13.11.33 (arachidonate 15-lipoxygenase) inhibitor; ferroptosis inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
Amalorin | | alkaloid; organic heterotetracyclic compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
sampangine | | alkaloid; organic heterotetracyclic compound | antifungal agent; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
discretamine | | berberine alkaloid; organic heterotetracyclic compound | EC 5.99.1.2 (DNA topoisomerase) inhibitor; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
tetrahydrocolumbamine | | berberine alkaloid; organic heterotetracyclic compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ergonovine | | ergot alkaloid; monocarboxylic acid amide; organic heterotetracyclic compound; primary alcohol; secondary amino compound; tertiary amino compound | diagnostic agent; fungal metabolite; oxytocic; toxin | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
costatolide | | cyclic ether; delta-lactone; organic heterotetracyclic compound; secondary alcohol | HIV-1 reverse transcriptase inhibitor; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
piperlactam s | | alkaloid; aromatic ether; gamma-lactam; organic heterotetracyclic compound; phenols | anti-inflammatory agent; antioxidant; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
6-methyl-12-indolo[1,2-c]quinazolinamine | | organic heterotetracyclic compound; organonitrogen heterocyclic compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
sb-224289 | | 1,2,4-oxadiazole; azaspiro compound; benzamides; organic heterotetracyclic compound | serotonergic antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
alsterpaullone | | C-nitro compound; caprolactams; organic heterotetracyclic compound | anti-HIV-1 agent; antineoplastic agent; apoptosis inducer; EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor; EC 2.7.11.22 (cyclin-dependent kinase) inhibitor; EC 2.7.11.26 (tau-protein kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
bryostatin 1 | | acetate ester; bryostatins; cyclic hemiketal; enoate ester; methyl ester; organic heterotetracyclic compound; secondary alcohol | alpha-secretase activator; anti-HIV-1 agent; antineoplastic agent; marine metabolite; protein kinase C agonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
azadirachtin | | acetate ester; azadirachtin; cyclic hemiketal; enoate ester; epoxide; methyl ester; organic heterotetracyclic compound; secondary alcohol; tertiary alcohol | hepatoprotective agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
geissospermine | | indole alkaloid; methyl ester; organic heteropentacyclic compound; organic heterotetracyclic compound | EC 3.1.1.7 (acetylcholinesterase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
maytansine | | alpha-amino acid ester; carbamate ester; epoxide; maytansinoid; organic heterotetracyclic compound; organochlorine compound | antimicrobial agent; antimitotic; antineoplastic agent; plant metabolite; tubulin modulator | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ellagic acid | | 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 | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
t-2 toxin | | acetate ester; organic heterotetracyclic compound; trichothecene | apoptosis inducer; cardiotoxic agent; DNA synthesis inhibitor; environmental contaminant; fungal metabolite; mycotoxin; neurotoxin | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
vinorelbine | | acetate ester; methyl ester; organic heteropentacyclic compound; organic heterotetracyclic compound; ring assembly; vinca alkaloid | antineoplastic agent; photosensitizing agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
rifamycin b | | acetate ester; carboxylic acid; organic heterotetracyclic compound; rifamycins | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2-tert-butyl-9-fluoro-3,6-dihydro-7h-benz(h)imidazo(4,5-f)isoquinoline-7-one | | organic heterotetracyclic compound; organofluorine compound | EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
arglabin | | epoxide; gamma-lactone; organic heterotetracyclic compound; sesquiterpene lactone | antineoplastic agent; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
rifamycin sv | | acetate ester; cyclic ketal; lactam; macrocycle; organic heterotetracyclic compound; polyphenol; rifamycins | antimicrobial agent; antitubercular agent; bacterial metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
muconomycin a | | epoxide; macrolide antibiotic; macrotriolide; organic heterotetracyclic compound; trichothecene | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
bryostatin 2 | | bryostatins; cyclic hemiketal; enoate ester; methyl ester; organic heterotetracyclic compound; secondary alcohol | antineoplastic agent; marine metabolite; protein kinase C agonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
1-azakenpaullone | | lactam; organic heterotetracyclic compound; organobromine compound; organonitrogen heterocyclic compound | EC 2.7.11.26 (tau-protein kinase) inhibitor; Wnt signalling activator | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ergoline | | diamine; ergoline alkaloid; indole alkaloid fundamental parent; indole alkaloid; organic heterotetracyclic compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
lergotrile | | organic heterotetracyclic compound; organonitrogen heterocyclic compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
px-866 | | acetate ester; delta-lactone; organic heterotetracyclic compound; tertiary amino compound | EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
xenovulene a | | cyclic ether; enone; organic heterotetracyclic compound; sesquiterpenoid | GABA antagonist; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
9-methoxycanthin-6-one | | aromatic ether; indole alkaloid; organic heterotetracyclic compound | antineoplastic agent; antiplasmodial drug; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
HT-2 toxin | | acetate ester; organic heterotetracyclic compound; trichothecene | apoptosis inducer; fungal metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
arisugacin | | aromatic ether; delta-lactone; enone; organic heterotetracyclic compound; tertiary alcohol | antimicrobial agent; EC 3.1.1.7 (acetylcholinesterase) inhibitor; metabolite; Penicillium metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
vinflunine | | acetate ester; methyl ester; organic heteropentacyclic compound; organic heterotetracyclic compound; semisynthetic derivative; vinca alkaloid | antineoplastic agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ossamycin | | cyclic hemiketal; macrolide antibiotic; organic heterotetracyclic compound; secondary alcohol; spiroketal; tertiary alcohol | antineoplastic agent; bacterial metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
liphagal | | aldehyde; cyclic ether; meroterpenoid; organic heterotetracyclic compound; polyphenol | EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
drymaritin | | enol ether; enone; indole alkaloid; organic heterotetracyclic compound | anti-HIV agent; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pyripyropene a | | organic heterotetracyclic compound; sesquiterpenoid | acyl-CoA:cholesterol acyltransferase 2 inhibitor; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
3-[(6aR,9R,10aR)-7-methyl-6,6a,8,9,10,10a-hexahydro-4H-indolo[4,3-fg]quinoline-9-yl]-1,1-diethylurea | | organic heterotetracyclic compound; organonitrogen heterocyclic compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
hapalindole u | | hapalindole; isocyanide; organic heterotetracyclic compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
chaetominine | | indole alkaloid; lactam; organic heterotetracyclic compound; quinazolines | metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
berkeleydione | | beta-diketone; cyclic terpene ketone; meroterpenoid; methyl ester; organic heterotetracyclic compound; terpene lactone; tertiary alcohol; tertiary alpha-hydroxy ketone | antineoplastic agent; cysteine protease inhibitor; Penicillium metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
caribenol a | | organic heterotetracyclic compound; terpene lactone; tertiary alcohol | antimalarial; antitubercular agent; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
cx 5461 | | diazepine; naphthyridine derivative; organic heterotetracyclic compound; pyrazines; secondary carboxamide | antineoplastic agent; apoptosis inducer; EC 2.7.7.6 (RNA polymerase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
lycojapodine a | | alkaloid; bridged compound; cyclic ketone; lactone; organic heterotetracyclic compound | anti-HIV-1 agent; EC 3.1.1.7 (acetylcholinesterase) inhibitor; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
aspirochlorine | | organic heterotetracyclic compound | Aspergillus metabolite | 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 |
afidopyropen | | cyclopropanecarboxylate ester; organic heterotetracyclic compound; pyridines; secondary alcohol | agrochemical; insecticide; TRPV channel modulator | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
stemmadenine | | Aspidosperma alkaloid; methyl ester; monoterpenoid indole alkaloid; organic heterotetracyclic compound; primary alcohol | plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
mycocyclosin | | 2,5-diketopiperazines; organic heterotetracyclic compound; polyphenol | metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
mk-8742 | | carbamate ester; imidazoles; L-valine derivative; N-acylpyrrolidine; organic heterotetracyclic compound; ring assembly | antiviral drug; hepatitis C virus nonstructural protein 5A inhibitor; hepatoprotective agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pf-06463922 | | aminopyridine; aromatic ether; azamacrocycle; benzamides; cyclic ether; monofluorobenzenes; nitrile; organic heterotetracyclic compound; pyrazoles | antineoplastic agent; EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
atogepant | | azaspiro compound; organic heterotetracyclic compound; piperidones; secondary carboxamide; trifluorobenzene | calcitonin gene-related peptide receptor antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
bictegravir | | monocarboxylic acid amide; organic heterotetracyclic compound; secondary carboxamide; trifluorobenzene | HIV-1 integrase inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
8,5'-cyclo-2'-deoxyguanosine | | aromatic amine; bridged compound; diol; N-glycosyl compound; organic heterotetracyclic compound | Mycoplasma genitalium metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
chlorendic acid | | bridged compound; dicarboxylic acid; organochlorine compound | carcinogenic agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
triethylenediamine | | bridged compound; diamine; saturated organic heterobicyclic parent; tertiary amino compound | antioxidant; catalyst; reagent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
cytisine | | alkaloid; bridged compound; lactam; organic heterotricyclic compound; secondary amino compound | nicotinic acetylcholine receptor agonist; phytotoxin; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
bicozamycin | | azabicycloalkane; bridged compound | antibacterial agent; antidiarrhoeal drug; antiinfective agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
alpha-bergamotene | | bridged compound; polycyclic olefin; sesquiterpene | plant metabolite; volatile oil component | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
tandospirone | | bridged compound; dicarboximide; N-alkylpiperazine; N-arylpiperazine; pyrimidines | antidepressant; anxiolytic drug | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ecteinascidin 743 | | 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 | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
lurasidone | | 1,2-benzisothiazole; bridged compound; dicarboximide; N-arylpiperazine | adrenergic antagonist; dopaminergic antagonist; second generation antipsychotic; serotonergic antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
stevioside | | beta-D-glucoside; bridged compound; diterpene glycoside; ent-kaurane diterpenoid; tetracyclic diterpenoid | anti-inflammatory agent; antineoplastic agent; antioxidant; hypoglycemic agent; plant metabolite; sweetening agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
steviol | | bridged compound; ent-kaurane diterpenoid; monocarboxylic acid; tertiary allylic alcohol; tetracyclic diterpenoid | antineoplastic agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
16beta,17-dihydroxy-ent-kaurane-19-oic acid | | bridged compound; diol; ent-kaurane diterpenoid; hydroxy monocarboxylic acid; primary alcohol; tertiary alcohol | anti-HIV agent; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
sordaricin | | 3-oxo monocarboxylic acid; aldehyde; bridged compound; primary alcohol; tetracyclic diterpenoid | antifungal agent; fungal metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
komaroviquinone | | bridged compound; lactol; p-quinones; tetracyclic diterpenoid | metabolite; trypanocidal drug | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
bicyclo(2.2.1)heptene | | bridged compound; carbobicyclic compound; cyclic olefin | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
iwr-1 exo | | bridged compound; dicarboximide | axin stabilizer | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
sf 2370 | | bridged compound; gamma-lactam; methyl ester; organic heterooctacyclic compound | antimicrobial agent; bacterial metabolite; EC 2.7.11.13 (protein kinase C) inhibitor; tropomyosin-related kinase B receptor antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
sr 144528 | | bridged compound; monochlorobenzenes; pyrazoles; secondary carboxamide | CB2 receptor antagonist; EC 2.3.1.26 (sterol O-acyltransferase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
catharanthine | | alkaloid ester; bridged compound; methyl ester; monoterpenoid indole alkaloid; organic heteropentacyclic compound; tertiary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
cedrene | | bridged compound; carbotricyclic compound; polycyclic olefin; sesquiterpene | human urinary metabolite; volatile oil component | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
yunaconitine | | acetate ester; aromatic ether; benzoate ester; bridged compound; diterpene alkaloid; organic heteropolycyclic compound; polyether; secondary alcohol; tertiary alcohol; tertiary amino compound | antifeedant; human urinary metabolite; phytotoxin; plant metabolite; xenobiotic | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ly 404039 | | bridged compound; dicarboxylic acid; non-proteinogenic amino acid derivative; organic heterobicyclic compound; sulfone | antipsychotic agent; anxiolytic drug; dopamine agonist; metabotropic glutamate receptor agonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ly 379268 | | amino dicarboxylic acid; bridged compound; organic heterobicyclic compound | antipsychotic agent; anxiolytic drug; metabotropic glutamate receptor agonist; neuroprotective agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
hu 308 | | aromatic ether; bridged compound; carbobicyclic compound; primary allylic alcohol; synthetic cannabinoid | anti-inflammatory agent; antihypertensive agent; apoptosis inhibitor; bone density conservation agent; CB2 receptor agonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
sativene | | bridged compound; sesquiterpene | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
benzoylaconine | | benzoate ester; bridged compound; diterpene alkaloid; organic heteropolycyclic compound; polyether; secondary alcohol; tertiary alcohol; tertiary amino compound; tetrol | phytotoxin; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
dihydroagarofuran | | bridged compound; cyclic ether; eudesmane sesquiterpenoid; organic heterotricyclic compound | metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
deoxyaconitine | | acetate ester; benzoate ester; bridged compound; diol; diterpene alkaloid; organic heteropolycyclic compound; polyether; secondary alcohol; tertiary amino compound | plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
oxypaeoniflora | | 4-hydroxybenzoate ester; beta-D-glucoside; bridged compound; cyclic acetal; lactol; monoterpene glycoside | plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
rubusoside | | beta-D-glucoside; bridged compound; steviol glycoside; tetracyclic diterpenoid | plant metabolite; sweetening agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
aspergillide b | | bridged compound; cyclic ether; macrolide; secondary alcohol | antineoplastic agent; Aspergillus metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
benzoylmesaconine | | benzoate ester; bridged compound; diterpene alkaloid; organic heteropolycyclic compound; polyether; secondary alcohol; tertiary alcohol; tertiary amino compound; tetrol | analgesic; antiinfective agent; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
albiflorin | | benzoate ester; beta-D-glucoside; bridged compound; gamma-lactone; monoterpene glycoside; secondary alcohol | neuroprotective agent; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
salvileucalin b | | bridged compound; diterpenoid; furans; gamma-lactone | antineoplastic agent; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
iwr-1 endo | | benzamides; bridged compound; dicarboximide; quinolines | axin stabilizer; Wnt signalling inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
N-[9-(dichloromethylene)-1,2,3,4-tetrahydro-1,4-methanonaphthalen-5-yl]-3-(difluoromethyl)-1-methylpyrazole-4-carboxamide | | aromatic amide; bridged compound; olefinic compound; organochlorine compound; organofluorine compound; pyrazoles | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
streptolydigin | | bridged compound; cyclic ketal; enol; monocarboxylic acid amide; N-glycosyl compound; organic heterobicyclic compound; pyrrolidinone; spiro-epoxide | antimicrobial agent; bacterial metabolite; EC 2.7.7.6 (RNA polymerase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ledipasvir | | azaspiro compound; benzimidazole; bridged compound; carbamate ester; carboxamide; fluorenes; imidazoles; L-valine derivative; N-acylpyrrolidine; organofluorine compound | antiviral drug; hepatitis C protease inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
aspergillide a | | bridged compound; cyclic ether; macrolide; secondary alcohol | antineoplastic agent; Aspergillus metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
capilliposide b | | alpha-L-arabinopyranoside; bridged compound; cyclic ether; diol; hexacyclic triterpenoid; hexanoate ester; lactol; secondary alcohol; tetrasaccharide derivative; triterpenoid saponin | antineoplastic agent; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
paeoniflorigenone | | alicyclic ketone; benzoate ester; bridged compound; cyclic acetal; lactol; monoterpenoid | neuromuscular agent; plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
arabinofuranosyluracil | | N-glycosyl compound | metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
thymine arabinoside | | N-glycosyl compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
rebeccamycin | | indolocarbazole; N-glycosyl compound; organic heterohexacyclic compound; organochlorine compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
8-azaadenosine | | N-glycosyl compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
clitocine | | N-glycosyl compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
nsc 154020 | | N-glycosyl compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
4'-azidocytidine | | N-glycosyl compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
5'-deoxy-5-fluorocytidine | | N-glycosyl compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
imidazoleacetic acid ribotide | | imidazoles; monocarboxylic acid; N-glycosyl compound; ribose monophosphate | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
3-deazauridine | | N-glycosyl compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
epz004777 | | N-glycosyl compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2,2'-thiodiethanol | | aliphatic sulfide; diol | antineoplastic agent; antioxidant; metabolite; solvent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
chloramphenicol | | C-nitro compound; carboxamide; diol; organochlorine compound | antibacterial drug; antimicrobial agent; Escherichia coli metabolite; geroprotector; Mycoplasma genitalium metabolite; protein synthesis inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
triethylene glycol | | diol; poly(ethylene glycol); primary alcohol | plasticiser | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
1-butyrylglycerol | | 1-monoglyceride; butyrate ester; diol; fatty acid ester | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
hexamethylene glycol | | diol; primary alcohol | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
1,2-cyclohexanediol | | diol | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ancitabine | | diol; organic heterotricyclic compound | antimetabolite; antineoplastic agent; prodrug | 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 |
diisopropanolnitrosamine | | diol; nitrosamine; secondary alcohol | carcinogenic agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
16-hydroxytestosterone | | 16alpha-hydroxy steroid; 17beta-hydroxy steroid; 3-oxo-Delta(4) steroid; androstanoid; C19-steroid; diol; secondary alcohol | androgen | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
nebivolol | | chromanes; diol; organofluorine compound; secondary alcohol; secondary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
oxetanocin a | | diol; nucleoside analogue; oxetanes; primary alcohol | anti-HIV agent; antibacterial agent; bacterial metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
nucleocidin | | 6-aminopurines; adenosines; diol; organofluorine compound; sulfamate ester | antibacterial agent; bacterial metabolite; nucleoside antibiotic; protein synthesis inhibitor; trypanocidal drug | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
betulin | | diol; pentacyclic triterpenoid | analgesic; anti-inflammatory agent; antineoplastic agent; antiviral agent; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2,5-bis(hydroxymethyl)furan | | diol; furans | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2,8-dihydroxyadenine | | 6-aminopurines; diol; heteroaryl hydroxy compound; oxopurine | human urinary metabolite; mammalian metabolite; mouse metabolite; nephrotoxic agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
erythrodiol | | diol; pentacyclic triterpenoid; primary alcohol; secondary alcohol | plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
fumitremorgin a | | aromatic ether; diol; indole alkaloid; organic heterohexacyclic compound; organic peroxide | mycotoxin | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
hawkinsin | | cycloalkene; cysteine derivative; dicarboxylic acid; diol; secondary allylic alcohol; tertiary allylic alcohol | biomarker; human urinary metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
veratrylglycerol-beta-guaiacyl ether | | dimethoxybenzene; diol | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
xv 638 | | 1,3-thiazoles; benzamides; diazepanone; diol; secondary alcohol; secondary carboxamide; ureas | HIV protease inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
picrotin | | diol; epoxide; gamma-lactone; organic heteropentacyclic compound; picrotoxane sesquiterpenoid; tertiary alcohol | plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
colforsin daropate | | acetate ester; carboxylic ester; cyclic ketone; diol; organic heterotricyclic compound; tertiary amino compound | adenylate cyclase agonist; antihypertensive agent; cardiotonic drug; vasodilator agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
fumonisin b2 | | diester; diol; fumonisin; primary amino compound | Aspergillus metabolite; carcinogenic agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
14,15-dihydroxyeicosatrienoic acid | | DHET; diol; secondary allylic alcohol | mouse metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
8-isoprostaglandin e2 | | cyclic ketone; diol; prostanoid; secondary alcohol | bronchoconstrictor agent; human metabolite; rat metabolite; vasoconstrictor agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
calcifediol | | D3 vitamins; diol; hydroxycalciol | bone density conservation agent; human metabolite; metabolite; mouse metabolite; nutraceutical | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
fortimicin a | | amino cyclitol glycoside; aminoglycoside antibiotic; diol; monocarboxylic acid amide; primary amino compound | antibacterial agent; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
8-hydroxygeraniol | | diol; monoterpenoid; prenols | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pederin | | cyclic ketal; diol; oxanes; polyketide; secondary alcohol; secondary carboxamide | antimitotic; antineoplastic agent; bacterial metabolite; vesicant | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ro 42-5892 | | cyclopropanes; diol; L-histidine derivative; secondary carboxamide; sulfone | antihypertensive agent; EC 3.4.23.15 (renin) inhibitor; peptidomimetic; vasodilator agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
riddelliine n-oxide | | diol; macrocyclic lactone; olefinic compound; organic heterotricyclic compound; primary alcohol; pyrrolizine alkaloid; tertiary alcohol; tertiary amine oxide | carcinogenic agent; genotoxin; human xenobiotic metabolite; Jacobaea metabolite; mutagen; rat metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
3-hydroxyretinol | | diol; retinoid | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
hypothemycin | | aromatic ether; diol; enone; epoxide; macrolide; phenols; polyketide; secondary alpha-hydroxy ketone | antifungal agent; antineoplastic agent; EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor; fungal metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
protylonolide | | diol; enone; macrolide | metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
alpha-onocerin | | diol; olefinic compound; secondary alcohol; triterpenoid | plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
neodysiherbaine a | | amino dicarboxylic acid; diol; furopyran; hydroxy carboxylic acid | animal metabolite; excitatory amino acid agonist; marine metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
cortistatin a | | cortistatins; diol; secondary alcohol | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
verruculogen | | aromatic ether; diol; indole alkaloid; organic heterohexacyclic compound; organic peroxide | Aspergillus metabolite; GABA modulator; mycotoxin; Penicillium metabolite; potassium channel blocker | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
resolvin e2 | | diol; hydroxy polyunsaturated fatty acid; resolvin; secondary allylic alcohol | anti-inflammatory agent; human xenobiotic metabolite; rat metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pamapimod | | aromatic amine; aromatic ether; difluorobenzene; diol; primary alcohol; pyridopyrimidine; secondary amino compound | antirheumatic drug; EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
triptotriterpenic acid a | | diol; hydroxy monocarboxylic acid; pentacyclic triterpenoid | plant metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
borrelidin | | aliphatic nitrile; diol; macrolide; monocarboxylic acid; secondary alcohol | antifungal agent; antimalarial; antimicrobial agent; antineoplastic agent; apoptosis inducer; bacterial metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
asperfuranone | | 2-benzofurans; cyclic ketone; diol; polyketide; secondary alcohol; tertiary alcohol; tertiary alpha-hydroxy ketone | antineoplastic agent; fungal metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
lancifodilactone g | | cyclic ether; diol; enol; gamma-lactone; oxaspiro compound; triterpenoid | anti-HIV agent; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pd 173074 | | aromatic amine; biaryl; dimethoxybenzene; pyridopyrimidine; tertiary amino compound; ureas | antineoplastic agent; EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor; fibroblast growth factor receptor antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
amitrole | | aromatic amine; triazoles | carotenoid biosynthesis inhibitor; EC 1.11.1.6 (catalase) inhibitor; herbicide | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
4-aminopyridine | | aminopyridine; aromatic amine | avicide; orphan drug; potassium channel blocker | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
5-(n,n-hexamethylene)amiloride | | aromatic amine; azepanes; guanidines; monocarboxylic acid amide; organochlorine compound; pyrazines | antineoplastic agent; apoptosis inducer; odorant receptor antagonist; sodium channel blocker | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ethylisopropylamiloride | | aromatic amine; guanidines; monocarboxylic acid amide; organochlorine compound; pyrazines; tertiary amino compound | anti-arrhythmia drug; neuroprotective agent; sodium channel blocker | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
tacrine | | acridines; aromatic amine | EC 3.1.1.7 (acetylcholinesterase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
tyrphostin ag957 | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ambroxol | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
dan 2163 | | aromatic amide; aromatic amine; benzamides; pyrrolidines; sulfone | environmental contaminant; second generation antipsychotic; xenobiotic | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
antazoline | | aromatic amine; imidazolines; tertiary amino compound | cholinergic antagonist; H1-receptor antagonist; xenobiotic | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
cgs 15943 | | aromatic amine; biaryl; furans; organochlorine compound; primary amino compound; quinazolines; triazoloquinazoline | adenosine A1 receptor antagonist; adenosine A2A receptor antagonist; antineoplastic agent; central nervous system stimulant | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
chlorambucil | | aromatic amine; monocarboxylic acid; nitrogen mustard; organochlorine compound; tertiary amino compound | alkylating agent; antineoplastic agent; carcinogenic agent; drug allergen; immunosuppressive agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
diclofenac | | 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 | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
doxazosin | | aromatic amine; benzodioxine; monocarboxylic acid amide; N-acylpiperazine; N-arylpiperazine; quinazolines | alpha-adrenergic antagonist; antihyperplasia drug; antihypertensive agent; antineoplastic agent; vasodilator agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
isothipendyl | | aromatic amine; tertiary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
lavendustin a | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2-hydroxy-5-(2,5-dihydrobenzyl)aminobenzoic acid | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
6-anilino-5,8-quinolinedione | | aminoquinoline; aromatic amine; p-quinones; quinolone | antineoplastic agent; EC 4.6.1.2 (guanylate cyclase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
mafenide | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
mesalamine | | amino acid; aromatic amine; monocarboxylic acid; monohydroxybenzoic acid; phenols | non-steroidal anti-inflammatory drug | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pargyline | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pd 153035 | | aromatic amine; aromatic ether; bromobenzenes; quinazolines; secondary amino compound | EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor; epidermal growth factor receptor antagonist | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pd 158780 | | aromatic amine; bromobenzenes; diamine; pyridopyrimidine; secondary amino compound | antineoplastic agent; EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pd 98059 | | aromatic amine; monomethoxyflavone | EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor; geroprotector | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
phenoxybenzamine | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ag 1879 | | aromatic amine; monochlorobenzenes; pyrazolopyrimidine | beta-adrenergic antagonist; EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor; geroprotector | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
imatinib | | aromatic amine; benzamides; N-methylpiperazine; pyridines; pyrimidines | antineoplastic agent; apoptosis inducer; tyrosine kinase inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
tripelennamine | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
4-aminodiphenylamine | | aromatic amine; secondary amino compound | allergen | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
4,4'-diaminodiphenylmethane | | aromatic amine | allergen; carcinogenic agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
dibenzylamine | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
benzoquinonium | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
N-[(2-chlorophenyl)methyl]-1-[4-[[(2-chlorophenyl)methylamino]methyl]cyclohexyl]methanamine | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
neutral red base | | aromatic amine; phenazines; primary amino compound; tertiary amino compound | acid-base indicator; dye; two-colour indicator | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
diphenylamine | | 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 | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
prothipendyl | | aromatic amine; tertiary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
guanazole | | aromatic amine; triazoles | antineoplastic agent; DNA synthesis inhibitor; EC 1.17.4.1 (ribonucleoside-diphosphate reductase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
amiloride | | aromatic amine; guanidines; organochlorine compound; pyrazines | diuretic; sodium channel blocker | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
6-aminonicotinic acid | | aminonicotinic acid; aminopyridine; aromatic amine | metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
trimetazidine | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
oryzalin | | aromatic amine; C-nitro compound; sulfonamide; tertiary amino compound | agrochemical; antimitotic; herbicide | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2-amino-3,8-dimethylimidazo(4,5-f)quinoxaline | | aromatic amine; imidazoquinoxaline | carcinogenic agent; genotoxin; Maillard reaction product; mutagen | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
acridine orange | | aminoacridines; aromatic amine; tertiary amino compound | fluorochrome; histological dye | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
4-(diethylamino)benzaldehyde | | aromatic amine; benzaldehydes; tertiary amino compound | EC 1.2.1.3 [aldehyde dehydrogenase (NAD(+))] inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
dibenzthione | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
8-azaadenine | | aromatic amine; nucleobase analogue; triazolopyrimidines | EC 1.17.3.2 (xanthine oxidase) inhibitor; Mycoplasma genitalium metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
lamtidine | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
bamipine | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
methyl 3-aminopyrazine-2-carboxylate | | aromatic amine; methyl ester; pyrazines | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
p-Aminosalicylic acid methyl ester | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
trimetazidine dihydrochloride | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
phenylisopropyladenosine | | aromatic amine; benzenes; hydrocarbyladenosine; purine nucleoside; secondary amino compound | adenosine A1 receptor agonist; neuroprotective agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
4-hydroxybenzylamine | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pomalidomide | | aromatic amine; dicarboximide; isoindoles; piperidones | angiogenesis inhibitor; antineoplastic agent; immunomodulator | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
hydromethylthionine | | aromatic amine; phenothiazines; tertiary amino compound | bacterial xenobiotic metabolite; fluorochrome; mouse metabolite; rat metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
8-amino-8-demethylriboflavin | | aromatic amine; benzopteridine; primary amino compound; tetrol | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
aminopyralid | | aromatic amine; organochlorine pesticide; pyridines | herbicide | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
lenalidomide | | aromatic amine; dicarboximide; isoindoles; piperidones | angiogenesis inhibitor; antineoplastic agent; immunomodulator | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
5-aminonicotinic acid | | aminonicotinic acid; aminopyridine; aromatic amine | metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
1-[4-[4-[(4-methylphenyl)methylamino]phenyl]-1-piperazinyl]ethanone | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
4-[2-[[4-(dimethylamino)phenyl]methylamino]ethyl]-2,2-dimethyl-4-oxanol | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
1-[4-[4-[(phenylmethyl)amino]phenyl]-1-piperazinyl]ethanone | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
7-(2-methyl-2,3-dihydroindol-1-yl)-3-(phenylmethyl)triazolo[4,5-d]pyrimidine | | aromatic amine; tertiary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
1-(4-chlorophenyl)-N-(2-furanylmethyl)-N-[[1-(2-methylbutan-2-yl)-5-tetrazolyl]methyl]methanamine | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
N-[(1-cyclohexyl-5-tetrazolyl)-thiophen-2-ylmethyl]-N-(phenylmethyl)ethanamine | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
5-[[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]methylamino]-2-(4-morpholinyl)benzoic acid | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
5-(2-phenylethyl)-1,3,4-thiadiazol-2-amine | | aromatic amine; thiadiazoles | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
iFSP1 | | aromatic amine; nitrile; primary amino compound; pyridobenzimidazole; toluenes | antineoplastic agent; ferroptosis inducer; ferroptosis suppressor protein 1 inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
N-(3-fluorophenyl)-2-(pyridin-4-yl)quinazolin-4-amine | | aromatic amine; monofluorobenzenes; pyridines; quinazolines; secondary amino compound; substituted aniline | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2-amino-4-(cyanomethyl)-6-(N-methylanilino)pyridine-3,5-dicarbonitrile | | aromatic amine; tertiary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
5-amino-3-(4-methoxyphenyl)-7-methyl-4-oxo-1-thieno[3,4-d]pyridazinecarboxylic acid methyl ester | | aromatic amine; thiophenes | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
4-[bis(phenylmethyl)amino]-2-(dimethylamino)-3-pyridinecarbonitrile | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2-[(3-fluorophenyl)methyl-(phenylmethyl)amino]ethanol | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2-methoxy-4-[[2-(methylthio)anilino]methyl]phenol | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
1-(4-ethylphenyl)-N-(3-pyridinylmethyl)methanamine | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
N-[(2,3-dimethoxyphenyl)methyl]-4-(4-methyl-1-piperidinyl)aniline | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2-amino-5-[diethylamino(oxo)methyl]-4-methyl-3-thiophenecarboxylic acid propan-2-yl ester | | aromatic amine; isopropyl ester; tertiary carboxamide; thiophenes | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
4-(2,3-dihydro-1H-indol-1-yl)-1-phenyl-1H-pyrazolo[3,4-d]pyrimidine | | aromatic amine; tertiary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
N-[(2-methoxyphenyl)methyl]-4-(1-piperidinyl)aniline | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
4-[methyl-(4-thiophen-2-yl-2-thiazolyl)amino]phenol | | aromatic amine; tertiary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
N-[(3-bromo-4,5-diethoxyphenyl)methyl]-4-(4-morpholinyl)aniline | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
4-[[5-chloro-2-[(4-fluorophenyl)methoxy]phenyl]methylamino]benzenesulfonamide | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2-[[2-[(2-fluorophenyl)methoxy]-3-methoxyphenyl]methylamino]phenol | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
xl147 | | aromatic amine; benzothiadiazole; quinoxaline derivative; sulfonamide | antineoplastic agent; EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
1-(4-acetyl-3,5-dimethyl-1H-pyrrol-2-yl)-2-[[4-(difluoromethoxy)-3-methoxyphenyl]methyl-methylamino]ethanone | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
(3-hydroxyphenyl)-[4-(phenylmethyl)-1-piperazinyl]methanethione | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
N-[4-[(3-bromo-5-methoxy-4-prop-2-enoxyphenyl)methylamino]-2-methoxyphenyl]-2-methylpropanamide | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2-chloro-N-[4-(N-propan-2-ylanilino)phenyl]acetamide | | aromatic amine; tertiary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
6-[[(2-chlorophenyl)methyl-methylamino]methyl]-N2-(2-methylphenyl)-1,3,5-triazine-2,4-diamine | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2-chloro-1-[4-[(3-methylphenyl)methyl]-1-piperazinyl]ethanone | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
N-{3-[(2-phenylquinazolin-4-yl)amino]phenyl}acetamide | | acetamide; aromatic amine; quinazolines; secondary amino compound; substituted aniline | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
1-(Benzylamino)-3-(3,4-dimethylphenoxy)propan-2-ol | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
3-(4-ethyl-1-piperazinyl)-5-methylpyridazino[3,4-b][1,4]benzoxazine | | aromatic amine; tertiary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
5-amino-3-[[[1-(2-furanylmethyl)-5-oxo-3-pyrrolidinyl]-oxomethoxy]methyl]thiophene-2,4-dicarboxylic acid dimethyl ester | | aromatic amine; thiophenes | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
1-(1-tert-butyl-5-tetrazolyl)-N-(phenylmethyl)-1-(3-pyridinyl)-N-(thiophen-2-ylmethyl)methanamine | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
3-[[4,6-bis(4-morpholinyl)-1,3,5-triazin-2-yl]amino]-3-(2-chlorophenyl)propanoic acid ethyl ester | | 1,3,5-triazines; aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2-(N-ethylanilino)-4-thieno[3,2-d][1,3]thiazinone | | aromatic amine; tertiary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
N4-ethyl-N6,1,2-trimethyl-N4-phenylpyrimidin-1-ium-4,6-diamine | | aromatic amine; tertiary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
N-(3-{[2-(2-fluorophenyl)quinazolin-4-yl]amino}phenyl)acetamide | | acetamide; aromatic amine; monofluorobenzenes; quinazolines; secondary amino compound; substituted aniline | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
N-(1-benzylpiperidin-4-yl)-2-(pyridin-3-yl)quinazolin-4-amine | | aromatic amine; piperidines; pyridines; quinazolines; secondary amino compound; tertiary amino compound | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
5-nitro-2-[(phenylmethyl)amino]benzoic acid [2-(cyclohexylamino)-2-oxoethyl] ester | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
GSK3-XIII | | aromatic amine; pyrazoles; quinazolines; secondary amino compound | EC 2.7.11.26 (tau-protein kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
b 43 | | aromatic amine; aromatic ether; cyclopentanes; primary amino compound; pyrrolopyrimidine | EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor; geroprotector | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2-(1-adamantyl)-4-chloro-5-[(4-fluorophenyl)methylamino]-3-pyridazinone | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
1-cyclohexyl-3-[1-[4-(phenylmethyl)-1-piperazinyl]-1-thiophen-2-ylpropan-2-yl]urea | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
r 115866 | | aromatic amine; benzothiazoles; secondary amino compound; triazoles | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
nsc 716970 | | aromatic amine; aromatic ether; indolecarboxamide; organochlorine compound | antineoplastic agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
n-methylbenzylamine hydrochloride | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pi103 | | aromatic amine; morpholines; organic heterotricyclic compound; phenols; tertiary amino compound | antineoplastic agent; EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor; mTOR inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
selexipag | | aromatic amine; ether; monocarboxylic acid amide; N-sulfonylcarboxamide; pyrazines; tertiary amino compound | orphan drug; platelet aggregation inhibitor; prodrug; prostacyclin receptor agonist; vasodilator agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
mre 269 | | aromatic amine; ether; monocarboxylic acid; pyrazines; sulfonamide; tertiary amino compound | drug metabolite; orphan drug; platelet aggregation inhibitor; prostacyclin receptor agonist; vasodilator agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
sch 51344 | | aromatic amine; aromatic ether; primary alcohol; pyrazoloquinoline; secondary amino compound | antineoplastic agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ageladine a | | alkaloid; aromatic amine; imidazopyridine; organobromine compound; pyrroles | angiogenesis inhibitor; antineoplastic agent; matrix metalloproteinase inhibitor; metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
azd2858 | | aromatic amine; N-methylpiperazine; pyrazines; pyridines; secondary carboxamide; sulfonamide | antineoplastic agent; bone density conservation agent; EC 2.7.11.26 (tau-protein kinase) inhibitor; Wnt signalling activator | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
4-aminopyridine-3-methanol | | aminopyridine; aromatic amine; aromatic primary alcohol | potassium channel blocker | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ethaboxam | | 1,3-thiazoles; aromatic amide; aromatic amine; nitrile; secondary amino compound; thiophenes | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
abt-737 | | aromatic amine; aryl sulfide; biphenyls; C-nitro compound; monochlorobenzenes; N-arylpiperazine; N-sulfonylcarboxamide; secondary amino compound; tertiary amino compound | anti-allergic agent; anti-inflammatory agent; antineoplastic agent; apoptosis inducer; B-cell lymphoma 2 inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
abt 869 | | aromatic amine; indazoles; phenylureas | angiogenesis inhibitor; antineoplastic agent; EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
gw9508 | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
idelalisib | | aromatic amine; organofluorine compound; purines; quinazolines; secondary amino compound | antineoplastic agent; apoptosis inducer; EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
trametinib | | acetamides; aromatic amine; cyclopropanes; organofluorine compound; organoiodine compound; pyridopyrimidine; ring assembly | anticoronaviral agent; antineoplastic agent; EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor; geroprotector | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ametoctradin | | aromatic amine; triazolopyrimidines | antifungal agrochemical; mitochondrial cytochrome-bc1 complex inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
vizamyl | | (18)F radiopharmaceutical; aromatic amine; benzothiazoles; secondary amino compound | radioactive imaging agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2-[(2-chloro-4-nitroanilino)methyl]-6-methoxyphenol | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
[(2S,4S)-4-(4-bromophenyl)-2-[[4-(hydroxymethyl)phenyl]methoxy]-3,4-dihydro-2H-pyran-6-yl]-[4-(phenylmethyl)-1-piperazinyl]methanone | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
gdc-0973 | | aromatic amine; difluorobenzene; N-acylazetidine; organoiodine compound; piperidines; secondary amino compound; tertiary alcohol | antineoplastic agent; EC 2.7.11.24 (mitogen-activated protein kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
gsk690693 | | 1,2,5-oxadiazole; acetylenic compound; aromatic amine; aromatic ether; imidazopyridine; piperidines; primary amino compound; tertiary alcohol | antineoplastic agent; EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
3-[[2-(4-bromophenyl)-1-oxoethyl]amino]-3-[4-[(4-fluorophenyl)methylamino]-3-nitrophenyl]propanamide | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
2-[4-[(4-cyclopentyloxyphenyl)methyl]-1-propan-2-yl-2-piperazinyl]ethanol | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pci 32765 | | acrylamides; aromatic amine; aromatic ether; N-acylpiperidine; pyrazolopyrimidine; tertiary carboxamide | antineoplastic agent; EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
PP121 | | aromatic amine; cyclopentanes; pyrazolopyrimidine; pyrrolopyridine | antineoplastic agent; EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor; tyrosine kinase inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
asp3026 | | aromatic amine; diamino-1,3,5-triazine; monomethoxybenzene; N-methylpiperazine; piperidines; secondary amino compound; sulfone | antimalarial; antineoplastic agent; apoptosis inducer; EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor; EC 6.1.1.6 (lysine--tRNA ligase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
1-[4-[4-[(3-methylphenyl)methylamino]phenyl]-1-piperazinyl]ethanone | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
mrt67307 | | aromatic amine | | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
GS-441524 | | aromatic amine; C-nucleoside; nitrile; pyrrolotriazine | anticoronaviral agent; antiviral agent; drug metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
lrrk2-in1 | | aromatic amine; aromatic ether; N-acylpiperidine; N-alkylpiperazine; pyrimidobenzodiazepine; secondary amino compound; tertiary amino compound | antineoplastic agent; EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
gilteritinib | | aromatic amine; monomethoxybenzene; N-methylpiperazine; oxanes; piperidines; primary carboxamide; pyrazines; secondary amino compound | antineoplastic agent; apoptosis inducer; EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ML240 | | aromatic amine; aromatic ether; benzimidazoles; primary amino compound; quinazolines; secondary amino compound | antineoplastic agent | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
xl765 | | aromatic amine; aromatic ether; benzamides; quinoxaline derivative; sulfonamide | antineoplastic agent; EC 2.7.1.137 (phosphatidylinositol 3-kinase) inhibitor; mTOR inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
GS-443902 | | aromatic amine; C-nucleoside; nitrile; organic triphosphate; pyrrolotriazine | anticoronaviral agent; antiviral drug; drug metabolite | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
acp-196 | | aromatic amine; benzamides; imidazopyrazine; pyridines; pyrrolidinecarboxamide; secondary carboxamide; tertiary carboxamide; ynone | antineoplastic agent; apoptosis inducer; EC 2.7.10.2 (non-specific protein-tyrosine kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
ly3009120 | | aminotoluene; aromatic amine; biaryl; monofluorobenzenes; phenylureas; pyridopyrimidine; secondary amino compound | antineoplastic agent; apoptosis inducer; autophagy inducer; B-Raf inhibitor; necroptosis inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
enasidenib | | 1,3,5-triazines; aminopyridine; aromatic amine; organofluorine compound; secondary amino compound; tertiary alcohol | antineoplastic agent; EC 1.1.1.42 (isocitrate dehydrogenase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
s 8932 | | aromatic amine; C-nucleoside; carboxylic ester; nitrile; phosphoramidate ester; pyrrolotriazine | anticoronaviral agent; antiviral drug; prodrug | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
can 508 | | aromatic amine; monoazo compound; phenols; pyrazoles | angiogenesis inhibitor; antineoplastic agent; apoptosis inducer; EC 2.7.11.22 (cyclin-dependent kinase) inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
tirapazamine | | aromatic amine; benzotriazines; N-oxide | antibacterial agent; antineoplastic agent; apoptosis inducer | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |
pp242 | | aromatic amine; biaryl; hydroxyindoles; phenols; primary amino compound; pyrazolopyrimidine | antineoplastic agent; mTOR inhibitor | 0 | 0 | | low | 0 | 0 | 0 | 0 | 0 | 0 |