DeepCoverMOA Drug Mechanisms of Action Dataset

Description protein expression profiles in HCT116 cell line following drug treatment
Measurement protein expression by mass spectrometry
Association gene-small molecule associations by differential expression of gene following small molecule perturbation
Category proteomics
Resource DeepCoverMOA
Citation(s)
Last Updated 2024 Apr 02
Stats
  1. 7750 genes
  2. 874 small molecule perturbations
  3. 173748 gene-small molecule perturbation associations

Data Access

API
Script

Visualizations

  • Gene Attribute

  • Gene Similarity

  • Attribute Similarity

  • UMAP

small molecule perturbation Gene Sets

874 sets of proteins with high or low expression relative to other proteins from the DeepCoverMOA Drug Mechanisms of Action dataset.

Gene Set Description
(4-Chlorobenzyl)pyridine
(RS)-PPG
(S)-(-)-Pindolol
(S)-Selisistat
(S)-Zopiclone
(Z)-Pugnac
1,4-DHNA
10074-G5
2,2'-Biquinoline
2,4-Dichlorophenol A dichlorophenol that is phenol carrying chloro substituents at positions 2 and 4.
2,6-Dichlorophenethylamine
2-Bromophenethylamine
2-Cl-IB-MECA
2-PMPA
3,5-Dichlorosalicylic acid
3-Benzotriazol-propionic acid
3-Benzyloxyaniline
3-Deazaneplanocin A
3-Hydroxyflavone
4,4'-Dichlorobenzil
4,4'-Dimethoxybenzil
4-Aminobenzohydrazide
4-Benzylpyridine
4-Methoxybenzoic acid
4-Methylhistamine An aralkylamino compound that is histamine bearing a methyl substituent at the 5 position on the ring.
4-Nitropiazthiole
4EGI-1
4mu8C
5-Ethynyluracil
5-Hydroxyflavone
5-R-Rivaroxaban
6-Aminochrysene
6-Mercaptopurine
6603-0104
7,3,4-THIF
7,8-Dihydroxyflavone
7-Hydroxycoumarine
9-Aminocamptothecin
A 1120
A 438079
A 803467
A 922500
A 967079
A-317491
a-Naphthoflavone
AA92593
Abemaciclib
Abiraterone1
Abiraterone2
ABL127
ABT-199
ABT-737
AC-7954
Ac-YVAD-CHO
ACA
Acamprosate
Acenaphthoquinone
Acetazolamide A thiadiazole that has formula C4H6N4O3S2.
Acifran
Acitretin
Actinonin
Actonel
AGI-6780
AGK2
AGN 190299
AK 7
AK-54059
AKR1C3-IN-1
Alectinib
Alfuzosin A tetrahydrofuranol that has formula C19H27N5O4.
Aliskiren
Alogliptin A piperidine that is 3-methyl-2,4-dioxo-3,4-dihydropyrimidine carrying additional 2-cyanobenzyl and 3-aminopiperidin-1-yl groups at positions 1 and 2 respectively (the R-enantiomer). Used in the form of its benzoate salt for treatment of type 2 diabetes.
Alosetron
alvimopan
AM 630
AM095
AM966
AMG 487
AMN 082
Amsacrine
Anacetrapib
Anagrelide A 1,5-dihydroimidazo[2,1-]quinazoline having an oxo substituent at the 2-position and chloro substituents at the 6- and 7-positions.
Anamorelin
Anastrozole A 1,2,4-triazole compound having a 3,5-bis(2-cyano-2-propyl)benzyl group at the 1-position.
APD668
Aprepitant
AQ-390/43364023
AR-C155858
Aripiprazole A quinolone that has formula C23H27Cl2N3O2.
ARL 17477
AS 1517499
AS-605240
Asarone A phenylpropanoid that is benzene substituted by methoxy groups at positions 1, 2 and 4 and a propen-1-yl group at position 5. It has been isolated from Acorus.
Ascomycin
Asimadoline
AT 406
Atglistatin
Atomoxetine A secondary amino compound having methyl and 3-(2-methylphenoxy)-3-phenylpropan-1-yl substituents.
Atosiban
AUDA
Avosentan
AXL1717
AZ 628
AZ20
AZ505
AZD 6482
AZD-5438
AZD1152
AZD1152-HQPA
AZD4547 A member of the class of benzamides that is a carboxamide resulting from the formal condensation of the carboxy group of 4-(cis-3,5-dimethylpiperazin-1-yl)benzoic acid with the amino substituent of 5-[2-(3,5-dimethoxyphenyl)ethyl]-1H-pyrazol-3-amine. It is an inhibitor of the fibroblast growth factor receptor (FGFR).
AZD7762
AZD8055
Azilsartan
Aztreonam
BACE1_In
Bafetinib
Bafilomycin A1 The most used of the bafilomycins, a family of toxic macrolide antibiotics derived from Streptomyces griseus.
Balicatib
Baricitinib
Basimglurant
BAY 57-1293
Bay 60-7550
BAY 61-3606
BBL003126
BBL023172
BCATc-In2
BCX 1470
BD 1008
BEC
Benethamine
Benzbromarone
Benzo[a]pyrene An ortho- and peri-fused polycyclic arene consisting of five fused benzene rings.
Bergenin
Berzosertib
Bestatin A peptide that has formula C16H24N2O4.
Betamethasone A glucocorticoid that has formula C22H29FO5.
Bexarotene
BHT
BI 2536
Bicifadine
Binospirone
Birabresib
Bisphenol A A bisphenol that is 4,4'-methanediyldiphenol in which the methylene hydrogens are replaced by two methyl groups.
BIX 01294
Blonanserin
BLZ-945
BML-277
BMS 303141
BMS 754807
BMS-5
BMS-536924
BMS-911543
BMS309403
BMY 7378
Boc-4mesyloxypiperidine
Bombesin
Bosentan
Bosutinib
BQ-788
Brequinar
BRL 54443
Bromfenac Amfenac in which the the hydrogen at the 4 position of the benzoyl group is substituted by bromine. It is used for the management of ocular pain and treatment of postoperative inflammation in patients who have undergone cataract extraction. It was withdrawn from the US market in 1998, following concerns over off-label abuse and hepatic failure.
Bromopyruvic acid
BS-181
Buspirone An azaspiro compound that is 8-azaspiro[4.5]decane-7,9-dione substituted at the nitrogen atom by a 4-(piperazin-1-yl)butyl group which in turn is substituted by a pyrimidin-2-yl group at the nitrogen atom.
BW 723C86
BX 471
BX 912
c-Fms-IN-3
CA-074
CAL-101
Calcipotriol A seco-cholestane that has formula C27H40O3.
Capsazepine A benzazepine that is 2,3,4,5-tetrahydro-1H-2-benzazepine which is substituted by hydroxy groups at positions 7 and 8 and on the nitrogen atom by a 2-(p-chlorophenyl)ethylaminothiocarbonyl group. A synthetic analogue of capsaicin, it was the first reported capsaicin receptor antagonist.
Carbamazepine A dibenzoazepine that is 5H-dibenzo[b,f]azepine carrying a carbamoyl substituent at the azepine nitrogen, used as an anticonvulsant.
Carprofen Propanoic acid in which one of the methylene hydrogens is substituted by a 6-chloro-9H-carbazol-2-yl group. A non-steroidal anti-inflammatory drug, it is no longer used in human medicine but is still used for treatment of arthritis in elderly dogs.
Carvedilol A member of the class of carbazoles that is an adrenergic antagonist with non-selective beta- and alpha-1 receptor blocking properties which helps in the management of congestive heart failure.
Castanospermine
CAY10550
CAY10650
CAY10683
CB 13
CB-839
CBIO
CBL0137
CC-401
CCT128930
CCT241533
Cediranib
Celastrol
Ceritinib A member of the class of aminopyrimidines that is 2,6-diamino-5-chloropyrimidine in which the amino groups at positions 2 and 6 are respectively carrying 2-methoxy-4-(piperidin-4-yl)-5-methylphenyl and 2-(isopropylsulfonylamino)phenyl substituents. Used for the treatment of ALK-positive metastatic non-small cell lung cancer.
Cetirizine A member of the class of piperazines that is piperazine in which the hydrogens attached to nitrogen are replaced by a (4-chlorophenyl)(phenyl)methyl and a 2-(carboxymethoxy)ethyl group respectively.
Cetrorelix
CGP77675
CGS 35066
CH-223191
CH5132799
CHCA
CHEMBL1348080
CHEMBL1436068
CHEMBL1597046
CHEMBL1643306
CHEMBL1902935
CHEMBL200403
CHEMBL2041153
CHEMBL217125
CHEMBL2172374
CHEMBL2397099
CHEMBL2431803
CHEMBL383736
CHEMBL513147
CHEMBL569227
CHEMBL570596
Chloro-L-alanine
Chlorsulfuron
CID-2745687
Cilengitide
Cilostamide
Cimetidine A member of the class of guanidines that consists of guanidine carrying a methyl substituent at position 1, a cyano group at position 2 and a 2-{[(5-methyl-1H-imidazol-4-yl)methyl]sulfanyl}ethyl group at position 3. It is a H2-receptor antagonist that inhibits the production of acid in stomach.
CJ-42794
Climbazole
Cloprostenol
Clorgiline
Clozapine A benzodiazepine that is 5H-dibenzo[b,e][1,4]diazepine substituted by a chloro group at position 8 and a 4-methylpiperazin-1-yl group at position 11. It is a second generation antipsychotic used in the treatment of psychiatric disorders like schizophrenia.
Compound-1a
conivaptan
CP 94253
CP-673451
CPI-203
Crizotinib
Cyanuric chloride
Cyclopamine A piperidine that has formula C27H41NO2.
CyPPA
Cysmethynil
Cytosporone B
CZC-25146
D-(+)-Glucose
D-3263
D399-0002
Dabigatran An aromatic amide obtained by formal condensation of the carboxy group of 2-{[(4-carbamimidoylphenyl)amino]methyl}-1-methyl-1H-benzimidazole-5-carboxylic acid with the secondary amoino group of N-pyridin-2-yl-beta-alanine. The active metabolite of the prodrug dabigatran etexilate, it acts as an anticoagulant which is used for the prevention of stroke and systemic embolism.
Dantrolene The hydrazone resulting from the formal condensation of 5-(4-nitrophenyl)furfural with 1-aminohydantoin.
Dapagliflozin
Dapiprazole
Darapladib
Darifenacin
Darunavir
Dasatinib
Debio-1347
Defactinib
Desipramine A dibenzoazepine consisting of 10,11-dihydro-5H-dibenzo[b,f]azepine substituted on nitrogen with a 3-(methylamino)propyl group.
Desvenlafaxine
Dexrazoxane
Dichlorisone
Dichlorphenamide
Dicumarol
Dicyclohexylamine
Diethylstilbestrol
Dihydroartemisinin A sesquiterpenoid compound which is used as a drug for treatment of malaria.
Dimethylfraxetin
Dinoprost
Dipyridamole A pyrimidopyrimidine that is 2,2',2'',2'''-(pyrimido[5,4-d]pyrimidine-2,6-diyldinitrilo)tetraethanol substituted by piperidin-1-yl groups at positions 4 and 8 respectively. A vasodilator agent, it inhibits the formation of blood clots.
DMB
Dopamine Catechol in which the hydrogen at position 4 is substituted by a 2-aminoethyl group.
Doramapimod
Dorzolamide 5,6-Dihydro-4H-thieno[2,3-b]thiopyran-2-sulfonamide 7,7-dioxide in which hydrogens at the 4 and 6 positions are substituted by ethylamino and methyl groups, respectively (4S, trans-configuration). A carbonic anhydrase inhibitor, it is used as the hydrochloride in ophthalmic solutions to lower increased intraocular pressure in the treatment of open-angle glaucoma and ocular hypertension.
DP-agonist13
DPP-IV-IN-2
Dronedarone
Duvelisib
DY 131
EIPA
Eletriptan
Eltrombopag
Encorafenib
Eniporide
Entinostat
Entospletinib
Enzalutamide
Enzastaurin
Eplerenone A steroid acid ester that has formula C24H30O6.
Epoxomicin A tripeptide consisting of an Ile-Ile-Thr-NH2 sequence N-substituted on the threonamide amidic nitrogen with a (2S)-4-methyl-1-[(2R)-2-methyloxiran-2-yl]-1-oxopentan-2-yl group and with acetyl and methyl groups on the nitrogen of the isoleucine residue distal to the threonamide; a naturally occurring selective proteasome inhibitor with anti-inflammatory activity.
Epristeride
Eptifibatide
EPZ-6438
EPZ004777
Erlotinib
Erythromycin Any of several wide-spectrum macrolide antibiotics obtained from actinomycete Saccharopolyspora erythraea (formerly known as Streptomyces erythraeus).
Esmolol A carboxylic ester that is methyl 3-(4-hydroxyphenyl)propanoate in which the hydrogen attached to the phenoic hydroxy group is substituted by a 2-hydroxy-3-(isopropylamino)propyl group. A cardioselective and short-acting beta1 receptor blocker with rapid onset but lacking intrinsic sympathomimetic and membrane-stabilising properties, it is used as the hydrochloride salt in the management of supraventricular arrhythmias, and for the control of hypertension and tachycardia during surgery.
Ethiprole A pyrazole that has formula C13H9Cl2F3N4OS.
Ethoxzolamide 1,3-Benzothiazole substituted a sulfonamide and an ethoxy group at positions 2 and 6, respectively. A carbonic anhydrase inhibitor, it has been used in the treatment of glaucoma, and as a diuretic.
Ethynyl Estradiol
Evacetrapib
EWP-815
Ezatiostat
Febuxostat
Fedratinib
Fenoldopam A benzazepine that has formula C16H16ClNO3.
Fevipiprant
Filanesib
Finasteride An aza-steroid that is a synthetic drug for the treatment of benign prostatic hyperplasia.
Fingolimod
FIPI HCl
FK866
Flavopiridol
Fluconazole A member of the class of triazoles that is propan-2-ol substituted at position 1 and 3 by 1H-1,2,4-triazol-1-yl groups and at position 2 by a 2,4-difluorophenyl group. It has been shown to exhibit antifungal activity.
Fluorescein
Fluoxymesterone An anabolic androgenic steroid that has formula C20H29FO3.
Fluticasone
FMK
fMLF
Formestane
Forodesine
FR 180204
FTI-277
Fumagillin A meroterpenoid resulting from the formal condensation of the hydroxy group of fumagillol with the carboxylic acid group of (all-E)-deca-2,4,6,8-tetraenedioic acid. Originally isolated from the fungus Aspergillus fumigatus, it is used for the control of Nosema infection in honey bees.
Fumitremorgin C
G-1
Gandotinib
GBR 12909
Gedatolisib
Gefitinib
Genistein 7-Hydroxyisoflavone with additional hydroxy groups at positions 5 and 4'. It is a phytoestrogenic isoflavone with antioxidant properties.
Ginkgolide A A diterpene lactone that has formula C20H24O9.
GK01981
Gliclazide
Glufosinate
Glycyrrhizic acid
GNE-9605
GNF-5
GR79236
GS-9620
GSK 650394
GSK-1070916
GSK-923295
GSK-LSD1
GSK126
GSK189254A
GSK2334470
GSK2578215
GSK2606414
GSK2636771
GSK2656157
GSK343
GSK4112
GSK429286A
Guanethidine
Guanfacine
GW 3965 A diarylmethane that has formula C33H31ClF3NO3.
GW 441756
GW 501516 An aromatic ether that is phenoxyacetic acid in which the phenyl group is substituted at position 2 by a methyl group and at position 4 by a (1,3-thiazol-5-ylmethyl)sulfanediyl group, and in which the 1,3-thiazolyl group is substituted at positions 2 and 4 by p-trifluoromethylphenyl and methyl groups, respectively.
GW311616
GW4064
GW7647
GW842166X
GW9508
H 89
H-1152
H-Arg(NO2)-OH
HA130
HC 030031
HC 067047
HFI-142
HhAntag
Histamine A 1H-imidazol-4-yl group substituted at position C-4 by a 2-aminoethyl group.
HJC0350
HMB-Val-Ser-Leu-VE
HMS3745G19
HPGDS-In1
Huperzine A A sesquiterpene alkaloid isolated from a club moss Huperzia serrata that has been shown to exhibit neuroprotective activity.
HX 531
HY-50713
I3C
IBC 293
Ibrutinib1
Ibrutinib2
Ibutamoren
Ibutilide
IC-87114
Icatibant
ICG-001
Iclaprim
Icotinib
Idasanutlin
Iloprost
Imiquimod An imidazoquinoline that has formula C14H16N4.
INCB 3284
Indapamide
Indomethacin
Ingenol-3-angelate
INT-747
IRAK-1-4 Inhibitor I
ISO-1
Isoproterenol
Isotretinoin A retinoic acid that is all-trans-retinoic acid in which the double bond which is alpha,beta- to the carboxy group is isomerised to Z configuration. A synthetic retinoid, it is used for the treatment of severe cases of acne and other skin diseases.
Ispinesib
IU1
Ivabradine
Ivacaftor
IWR-1
JNJ-38877605
JP1302
JQ-1
JTE 013
JW 480
JZL 184
Kaempferide
kb NB 142-70
KH-CB19
KH7
KM03430
ko143
KPT-330
KU 55933
KU-60019
L-165041
L-168,049
L-741
L-779450
L-Cysteine An optically active form of cysteine having L-configuration.
L-Menthol
L-Mimosine
L-NIL
L-Valyl-L-phenylalanine
L755507
Lalistat1
Lapatinib
Laropiprant
Lasmiditan
LCL161
LDN-192960
Leupeptin A peptide that has formula C20H38N6O4.
Levosimendan
Linagliptin
Lixivaptan
LOMEGUATRIB
Lomitapide A member of the class of benzamides obtained by formal condensation of the carboxy group of 4'-(trifluoromethyl)biphenyl-2-carboxylic acid with the primary amino group of 9-[4-(4-aminopiperidin-1-yl)butyl]-N-(2,2,2-trifluoroethyl)-9H-fluorene-9-carboxamide. Used (as its mesylate salt) as a complement to a low-fat diet and other lipid-lowering treatments in patients with homozygous familial hypercholesterolemia.
Lorcaserin
LP-533401
LPA2 An1
LUBIPROSTONE
LUF-5735
LXR-623
LY 344864
LY 364947
LY 487379
LY2090314
LY2365109
LY2584702
LY2801653
LY334370
LY411575
Macitentan A member of the class of sulfamides in which the two amino groups of sulfonamide are substituted by 5-(4-bromophenyl)-6-{2-[(5-bromopyrimidin-2-yl)oxy]ethoxy}pyrimidin-4-yl and propyl groups. An orphan drug used for the treatment of pulmonary arterial hypertension.
Maraviroc
Mardepodect
Marimastat A tricarboxylic acid triamide that has formula C15H29N3O5.
Mavorixafor
MBX-2982
MEK162
Meloxicam
MERCK544
Methazolamide
Methylnaltrexone
Metolazone
Metyrapone
MF63
MG-132
MI-3
MI-773
Mianserin
Midostaurin
Mifepristone
Migalastat
Mildronate
Milrinone A member of the class of bipyridines that is 2-pyridone which is substituted at positions 3, 5, and 6 by cyano, pyrid-4-yl, and methyl groups, respectively. It is used (particularly intravenously, as the lactate) for the short-term management of severe heart failure.
Minocycline A tetracycline analogue having a dimethylamino group at position 7 and lacking the methyl and hydroxy groups at position 5.
Mirabegron
MK 886
MK-1775
MK-3207
MK-6892
MK2206
ML-265
ML-323
mL167
ML218
ML221
mL347
ML349
ML365
MLN 8237
MLN4924
MLS0315771
MN-64
Molindone
Momelotinib
Montelukast An aliphatic sulfide that has formula C35H36ClNO3S.
Moxonidine
MPI-0479605-HCL
MRE-269
MRS 1754
MRS 2578
Mubritinib
Mycophenolic acid
N6022
Nafamostat
Nateglinide
Navarixin
NB-598
NBI-74330
NBTGR
NDT 9513727
Necrostatin 2
Neurokinin A A polypeptide that has formula C50H80N14O14S.
Nexturastat A
NFPS
NIBR189
Nifedipine A dihydropyridine that has formula C17H18N2O6.
Nilotinib
Nisoldipine
Nitisinone
NMS-873
NNC 26-9100
Nolatrexed
NP118809
NS 3763
NS309
NSC 23766
NSC 87877
NSC19883
NSC43673
NSC735380
NSC95682
NU 7026
NU7441
Nutlin3a
NVP-BEP800
NVP-BHG712
NVP-BSK805
Obatoclax
Octreotide A homodetic cyclic peptide that has formula C49H66N10O10S2.
Odanacatib
Olanzapine A benzodiazepine that has formula C17H20N4S.
Olaparib A member of the class of N-acylpiperazines obtained by formal condensation of the carboxy group of 2-fluoro-5-[(4-oxo-3,4-dihydrophthalazin-1-yl)methyl]benzoic acid with the free amino group of N-(cyclpropylcarbonyl)piperazine.
Olcegepant
Oleanolic Acid A pentacyclic triterpenoid that is olean-12-en-28-oic acid substituted by a beta-hydroxy group at position 3.
Olodaterol A member of the class of benzoxazine that is 6-hydroxy-1,4-benzoxazin-3-one in which the hydrogen at position 4 is replaced by a (1R)-1-hydroxy-2-{[1-(4-methoxyphenyl)-2-methylpropan-2-yl]amino}ethyl group. Used (as its hydrochloride salt) for long-term treatment of airflow obstruction in patients with chronic obstructive pulmonary disease including chronic bronchitis and/or emphysema.
Olopatadine
Olvance
ONX 0914
Org25543
Orteronel
OSI-027
Osilodrostat
Ospemifene An organochlorine compound that is a selective estrogen receptor modulator; used for treatment of dyspareunia.
OSU-03012
OTSSP167
Ozagrel
p-Tolylboronic acid
P005091
PAC-1
Palbociclib
Paliperidone
Palonosetron
Pamidronic acid
Pamoic Acid A dicarboxylic acid that has formula C23H16O6.
PAP-1
Papaverine A benzylisoquinoline alkaloid that is isoquinoline substituted by methoxy groups at positions 6 and 7 and a 3,4-dimethoxybenzyl group at position 1. It has been isolated from Papaver somniferum.
Parecoxib
Paricalcitol
Paroxetine A benzodioxole that consists of piperidine bearing 1,3-benzodioxol-5-yloxy)methyl and 4-fluorophenyl substituents at positions 3 and 4 respectively; the (3S,4R)-diastereomer. Highly potent and selective 5-HT uptake inhibitor that binds with high affinity to the serotonin transporter (Ki = 0.05 nM). Ki values are 1.1, 350 and 1100 nM for inhibition of [3H]-5-HT, [3H]-l-NA and [3H]-DA uptake respectively. Displays minimal affinity for alpha1-, alpha2- or beta-adrenoceptors, 5-HT2A, 5-HT1A, D2 or H1 receptors at concentrations below 1000 nM, however displays weak affinity for muscarinic ACh receptors (Ki = 42 nM). Antidepressant and anxiolytic in vivo.
Pazopanib
PCI-34051
PD 123319
PD 160170
PD 176252
PD173212
PDE-9i
PDK1-In
Pentadecanoyl EA
Pepstatin A
Perhexiline
Perindopril An alpha-amino acid ester that is the ethyl ester of N-{(2S)-1-[(2S,3aS,7aS)-2-carboxyoctahydro-1H-indol-1-yl]-1-oxopropan-2-yl}-L-norvaline
PF 04447943
PF 4800567
PF-04418948
PF-04620110
PF-3758309
PF-431396
PF-514273
PF-543
PF-8380
PF429242
PHA 767491
Phenylboronic acid
Pictilisib
Pimavanserin
Pinometostat
Pirenzepine
Pitolisant
PJ34
PLX-4720
PNU-120596
Pomalidomide An aromatic amine that is thalidomide substituted at position 4 on the isoindole ring system by an amino group. Used for the treatment of multiple myeloma in patients who failed to respond to previous therapies.
PP 1
PP2
Pramipexole A member of the class of benzothiazoles that is 4,5,6,7-tetrahydro-1,3-benzothiazole in which the hydrogens at the 2 and 6-pro-S-positions are substituted by amino and propylamino groups, respectively.
Prinomastat
Probenecid
Progesterone A C21-steroid hormone in which a pregnane skeleton carries oxo substituents at positions 3 and 20 and is unsaturated at C(4)-C(5). As a hormone, it is involved in the female menstrual cycle, pregnancy and embryogenesis of humans and other species.
PRT062607
Prucalopride
PRX-08066
PS-1145
Purvalanol
PX-12
Pyrene An ortho- and peri-fused polycyclic arene consisting of four fused benzene rings, resulting in a flat aromatic system.
Pyrimethamine
QNZ
Quetiapine A dibenzothiazepine that has formula C21H25N3O2S.
Quiflapon
Quinidine A cinchona alkaloid consisting of cinchonine with the hydrogen at the 6-position of the quinoline ring substituted by methoxy.
Quisinostat
Quizartinib
QX 314
R-848
R121919
Racecadotril
Radicicol An antifungal macrolactone antibiotic, obtained from Diheterospora chlamydosporia and Chaetomium chiversii that inhibits protein tyrosine kinase and heat shock protein 90 (Hsp90).
Ralfinamide
Raloxifene A benzothiophene that has formula C28H27NO4S.
Ramelteon
Repaglinide
Resmetirom
Retigabine
Reversine A member of the class of purines that is 9H-purine in which the hydrogens at positions 2 and 6 are replaced by a [4-(morpholin-4-yl)phenyl]nitrilo group and a cyclohexylamino group, respectively.
RF9
RG2833
RGFP966
RH00511
Rhodanine derivative38
Ribociclib
Rifampicin A rifamycin that is a a semisynthetic antibiotic derived from Amycolatopsis rifamycinica (previously known as Amycolatopsis mediterranei and Streptomyces mediterranei)
Rifaximin
Rimonabant
Ripasudil
Rislenemdaz
Rivastigmine
RK-24466
RN-1734
RN486
Ro 28-1675
Ro 48-8071
Ro-3306
RO495
Rofecoxib
Roflumilast
Rolapitant
Rosiglitazone
Rotigotine
Roxatidine
RRD-251
RS 67333
Ruboxistaurin
Rucaparib
Rucinol
Rupatadine
Ruxolitinib
RVX-208
RWJ 50271
S107
Salmeterol
Sapropterin
SAR020106
SAR7334
Saracatinib
SB 216763
SB 218795
SB 225002
SB 334867
SB 525334
SB 699551
SB-222200
SB-224289
SB-269970
SB-408124
SB-674042
SB290157
SC 560
SCH 530348
SCH 58261
SCHEMBL5061501
SD-208
Selisistat
Senicapoc
Seratrodast
SGC0946
SGI-1776
SH-4-54
Sildenafil
Silmitasertib
Silodosin
Simvastatin A fatty acid ester comprising a dihydroxyheptanoic acid unit condensed into a lactone; a partially reduced naphthalene structure; and a 2,2-dimethylbutyric acyl substituent at C17. It is used as a cholesterol-lowering and anti-cardiovascular disease drug.
Siponimod
Sitagliptin A triazolopyrazine that exhibits hypoglycemic activity.
Sitaxsentan
SKF 89976A
SKI II
SMI-16a
Sotrastaurin
SP2509
SP600125
Spautin-1
SPB06189
Spironolactone A steroid lactone that is 17alpha-pregn-4-ene-21,17-carbolactone substituted by an oxo group at position 3 and an alpha-acetylsulfanyl group at position 7.
SR 11237
SR 142948
SR 27897
SR 3335
SSR 69071
SSR128129E
STF-31
Stiripentol
STK066844
STK155799
STK235555
STK368746
STK410281
STK410283
STK416816
STK746869
STK772817
STK832240
STK841699
STK869906
STL304557
STL321288
STL336112
STX-0119
Succinobucol
Sulcotrione
Sulfanilamide A sulfonamide in which the sulfamoyl functional group is attached to aniline at the 4-position.
Sulforaphane
Sultiame
Sumatriptan A sulfonamide that consists of N,N-dimethyltryptamine bearing an additional (N-methylsulfamoyl)methyl substituent at position 5. Selective agonist for a vascular 5-HT1 receptor subtype (probably a member of the 5-HT1D family).
Sunitinib A pyrrole that has formula C22H27FN4O2.
T-00127_HEV1
T3
Tacrine
Tacrolimus
Tadalafil
TAE 226
Tafamidis
Tafluprost
TAK-285
TAK-779
TAK-875
Talazoparib
Tamibarotene A tetralin that has formula C22H25NO3.
Tandutinib
Tanomastat
Taranabant
Tasimelteon A member of the class of 1-benzofurans that is propionamide in which one of the amide hydrogens is replaced by a [(1R,2R)-2-(2,3-dihydro-1-benzofuran-4-yl)cyclopropyl]methyl group. A melatonin receptor agonist used for the treatment of non-24-hour sleep-wake disorder.
Tazarotene1
Tazarotene2
TC-N 22A
TC-O 9311
TCS 1102
TCS ERK 11e
TCS PIM-1 1
TCS-OX2-29
Teijin compound 1
Telmisartan
Telotristat
Terazosin A piperazine that has formula C19H25N5O4.
Terbinafine
Testolactone
Tetrindole
Tezacaftor
TGX-221
Thiamet G
Thiothixene
Thymidine A pyrimidine 2'-deoxyribonucleoside having thymine as the nucleobase.
Tiagabine
Ticagrelor
Tideglusib
Timapiprant
Tipifarnib
Tipiracil
Tiplaxtinin
Tirofiban
Tivozanib
Tizanidine 2,1,3-Benzothiadiazole substituted at C-4 by a Delta(1)-imidazolin-2-ylamino group and at C-4 by a chloro group. It is an agonist at alpha2-adrenergic receptor sites.
TMN 355
TMP269
TNP-470
Toceranib
TOFA
Tofacitinib
Tolimidone
Tolvaptan
Topiramate A hexose derivative that is 2,3:4,5-di-O-isopropylidene-beta-D-fructopyranose in which the hydroxy group has been converted to the corresponding sulfamate ester. It blocks voltage-dependent sodium channels and is used as an antiepileptic and for the prevention of migraine.
Torasemide An N-sulfonylurea obtained by formal condensation of [(3-methylphenyl)amino]pyridine-3-sulfonic acid with the free amino group of N-isopropylurea.
Torcetrapib A (trifluoromethyl)benzene that has formula C26H25F9N2O4.
Tozasertib
TPCA-1
TPPB
TR-14035
TRAM-34 An organochlorine compound that has formula C22H17ClN2.
Tranexamic acid
Treprostinil
Triclabendazole
Trihydroxyisoflavone
Tropicamide
Tubastatin A
Turofexorate
UAMC00039
UK 356618
UK 383367
Ulipristal
UMI-77
UNC 0631
UNC 0638
UNC1215
UNC2250
UNC2881
Undecanoic acid A straight-chain, eleven-carbon saturated medium-chain fatty acid found in body fluids; the most fungitoxic of the C7:0 - C18:0 fatty acid series.
UPF 648
Uridine
Ursodiol
Varespladib
Vatalanib
VE-821
Veliparib
Vemurafenib
Vernakalant
Vicriviroc
Vidofludimus
Vilazodone
Volasertib
Vorinostat
VPC23019
VTP-27999
VU 0364439
VU 0364739
VU0152100
VUF11207
W-13 HCl
WAY 170523
WAY 316606
WH-4-023
WZ811
XAV 939
XCT 790 A cinnamamide that has formula C23H13F9N4O3S.
XEN 103
XEN445
Y-33075
YK-4-279
Yohimbine An indole alkaloid with alpha2-adrenoceptor antagonist activity. It is produced by Corynanthe johimbe and Rauwolfia serpentina.
Z32036776
Zafirlukast A carbamate ester that has formula C31H33N3O6S.
Zaltoprofen
ZD 7288
Zebularine
ZINC2093649
ZINC6198410
ZINC8945
Ziprasidone A piperazine compound having 1,2-benzothiazol-3-yl- and 2-(6-chloro-1,3-dihydro-2-oxindol-5-yl)ethyl substituents attached to the nitrogen atoms.
ZJ 43
ZM 241385
ZM 336372
Zofenopril
Zonisamide A 1,2-benzoxazole compound having a sulfamoylmethyl substituent at the 3-position.
Zosuquidar
Zotarolimus
[Pyr1]-Apelin-13