Compound Name
(alphabetical) | Enz. Inhib. Data | ITC Data | Binding Targets | Alternate Compound Names |
|---|
| Ki | IC50 | Kd | EC50 | Koff | Kon | Other |
|---|
BDBM15296
 | 3 | 46 | 0 | 0 | 0 | 0 | 0 | 0 | - Cyclooxygenase-1 (COX-1)
- Heart phosphodiesterase
- Phosphodiesterase (TcrPDEC)
- Phosphodiesterase 1
- Phosphodiesterase 3
- Phosphodiesterase 3 (PDE3)
- Phosphodiesterase 3A
- Phosphodiesterase 4
- Phosphodiesterase 4A
- Phosphodiesterase 5A
- Phosphodiesterase Type 3 (PDE3A)
- Phosphodiesterase Type 3 (PDE3B)
- cGMP-dependent 3',5'-cyclic phosphodiesterase
- cGMP-specific 3',5'-cyclic phosphodiesterase
| - 6-methyl-2-oxo-5-(pyridin-4-yl)-1,2-dihydropyridine-3-carbonitrile
- 6-methyl-2-oxo-5-pyridin-4-yl-1H-pyridine-3-carbonitrile
- CHEMBL189
- Milrinone
- Primacor
- US9242982, Milrinone
- US9249139, Milrinone
|
BDBM19428
 | 9 | 40 | 0 | 0 | 0 | 0 | 0 | 0 | - Cytochrome P450 3A
- Histone Deacetylase 10 (HDAC10)
- Histone Deacetylase 4 (HDAC4) Mutant (H976Y)
- Histone deacetylase 1
- Histone deacetylase 11
- Histone deacetylase 2
- Histone deacetylase 3
- Histone deacetylase 4
- Histone deacetylase 5
- Histone deacetylase 6
- Histone deacetylase 7
- Histone deacetylase 8
- Histone deacetylase 9
- Potassium voltage-gated channel subfamily H member 2
| - (2E)-N-hydroxy-3-(4-{[(2-hydroxyethyl)[2-(1H-indol-3-yl)ethyl]amino]methyl}phenyl)prop-2-enamide
- (E)-N-hydroxy-3-[4-[[2-hydroxyethyl-[2-(1H-indol-3-yl)ethyl]amino]methyl]phenyl]prop-2-enamide
- CHEMBL356066
- Dacinostat
- LAQ-824
- NVP-LAQ824
|
BDBM22449
 | 14 | 32 | 0 | 3 | 0 | 0 | 0 | 0 | - Histone Deacetylase 10 (HDAC10)
- Histone deacetylase 1
- Histone deacetylase 11
- Histone deacetylase 2
- Histone deacetylase 3
- Histone deacetylase 3/Nuclear receptor corepressor 2
- Histone deacetylase 4
- Histone deacetylase 5
- Histone deacetylase 6
- Histone deacetylase 7
- Histone deacetylase 8
- Histone deacetylase 9
- Histone deacetylase HD2
- Leukotriene A4 hydrolase
| - CHEMBL356769
- N-(4-{(2R,4R,6S)-4-{[(4,5-diphenyl-1,3-oxazol-2-yl)sulfanyl]methyl}-6-[4-(hydroxymethyl)phenyl]-1,3-dioxan-2-yl}phenyl)-N -hydroxyoctanediamide
- Tubacin
- US9249087, Tubastatin A
|
BDBM23165
 | 5 | 6 | 0 | 38 | 0 | 0 | 0 | 0 | - Sphingosine 1-Phosphate Receptor 2
- Sphingosine 1-Phosphate Receptor 4
- Sphingosine 1-phosphate receptor 1
- Sphingosine 1-phosphate receptor 3
- Sphingosine 1-phosphate receptor 5
| - CHEMBL366208
- FTY720-phosphate, (S)-2
- [(2S)-2-amino-3-hydroxy-2-[2-(4-octylphenyl)ethyl]propoxy]phosphonic acid
|
BDBM32020
 | 1 | 42 | 0 | 6 | 0 | 0 | 0 | 0 | - 12-Lipoxygenase (12-LOX)
- 15-Lipoxygenase (LoxA)
- 15-Lipoxygenase-2 (15-LOX-2)
- Arachidonate 15-lipoxygenase
- Arachidonate 5-lipoxygenase
- Caspase-1
- Cyclooxygenase
- Estrogen receptor
- Gag-Pol polyprotein
- Glucose 6-phosphate dehydrogenase (G6PD)
- Heat shock protein HSP 90-alpha
- Hsf1 protein
- LTB4R
- Lipoxygenase
- Lipoxygenase (LOX)
- Lipoxygenase (SLO)
- Lipoxygenase-1
- POsterior Segregation family member (pos-1)
- RNA polymerase beta subunit (EC 2.7.7.6)
- RecName: Full=Zinc finger protein mex-5
- Seed linoleate 9S-lipoxygenase
- Transthyretin
- glucose-6-phosphate dehydrogenase-6-phosphogluconolactonase
- large T antigen
- tyrosine 3-monooxygenase/tryptophan 5-monooxygenase activation protein, gamma polypeptide
| - 4-[4-(3,4-dihydroxyphenyl)-2,3-dimethyl-butyl]pyrocatechol
- 4-[4-(3,4-dihydroxyphenyl)-2,3-dimethylbutyl]benzene-1,2-diol
- 4-[4-[3,4-bis(oxidanyl)phenyl]-2,3-dimethyl-butyl]benzene-1,2-diol
- BDBM166684
- CHEMBL52
- LOX inhibitor, N/A
- MLS000069451
- NORDIHYDROGUAIARETIC ACID
- Nordihydroguaiaretic acid (NDGA)
- SMR000059049
- cid_4534
|
BDBM50002692
 | 10 | 22 | 1 | 16 | 0 | 0 | 0 | 0 | - C-X-C chemokine receptor type 4 (CXCR4)
- DNA polymerase beta
- HIV-1 B HXB2-LAI-IIIB-BRU
- HIV-1 protease
- Human immunodeficiency virus type 1 protease
- Human immunodeficiency virus type 1 reverse transcriptase
- PKC alpha and beta-2
- Protein kinase C, epsilon
- Reverse transcriptase
- Serum albumin
- Thymidine kinase
- Thymidine kinase, cytosolic
- Thymidylate kinase
- Uridine-5'-diphosphoglucuronosyltransferase 2B7
| - (AZT) 1-(4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione
- (AZT)1-(4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione
- 1-((2R,4R,5S)-4-azido-5-(hydroxymethyl)tetrahydrofuran-2-yl)-5-methylpyrimidine-2,4(1H,3H)-dione
- 1-((2R,4S,5S)-4-(diazoamino)-5-(hydroxymethyl)-tetrahydrofuran-2-yl)-5-methylpyrimidine-2,4(1H,3H)-dione
- 1-((2R,4S,5S)-4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione
- 1-((2R,4S,5S)-4-azido-5-(hydroxymethyl)-tetrahydrofuran-2-yl)-5-methylpyrimidine-2,4(1H,3H)-dione
- 1-((2R,4S,5S)-4-azido-5-(hydroxymethyl)tetrahydrofuran-2-yl)-5-methylpyrimidine-2,4(1H,3H)-dione
- 1-((2R,5S)-4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione
- 1-((2S,4R,5R)-4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione
- 1-(4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione
- 1-(4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione (AZT)
- 1-(4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione (AzddThd, AZT)
- 1-(4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione (N3ddThd)
- 1-(4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione [AZT]
- 1-(4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione(3'-azido-2',3'-dideoxythymidine)
- 1-(4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione(AZT)
- 1-(4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione(Zidovudine, AZT)
- 1-(4-Azido-5-hydroxymethyl-tetrahydro-furan-2-yl)-5-methyl-1H-pyrimidine-2,4-dione(azidothymidine, AZT)
- 3'-Azido-3'-deoxy-thymidine
- 3'-Deoxy-3-azidothymidine
- 3'-azido-2',3'-dideoxythymidine
- 3'-azido-thymidine
- 3'azido-2'3'-dideoxythymidine
- 3-((2S,3S,5R)-2-(hydroxymethyl)-5-(5-methyl-2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)tetrahydrofuran-3-yl)triaz-1-en-2-ium-1-ide
- 4-(4-Azido-5-hydroxy-tetrahydro-furan-2-yl)-5-methyl-3H-pyrazine-2,6-dione
- AZT
- BW-A-509U
- BWA509U
- CHEMBL129
- Retrovir
- US10071110, Compound AZT
- ZIDOVUDINE
- azidothymidine
- zidovudin
- zudovidine
|
BDBM50017181
 | 4 | 12 | 0 | 33 | 0 | 0 | 0 | 0 | - Melanocortin receptor 1
- Melanocortin receptor 3
- Melanocortin receptor 3 (MC3R)
- Melanocortin receptor 4
- Melanocortin receptor 5
- Melanocortin receptor 5 (MC5R)
- Melanocyte-stimulating hormone receptor
| |
BDBM50017376
 | 4 | 43 | 2 | 0 | 0 | 0 | 0 | 0 | - Bile salt export pump
- Calcium channel
- Calcium channel (Type L)
- Cytochrome P450 2J2
- Cytochrome P450 3A
- Histamine H1 receptor
- Muscarinic acetylcholine receptor M1
- Neurokinin 1 receptor
- P-glycoprotein (P-gp)
- P-glycoprotein 1
- P-glycoprotein 1 and 3 (MDR1a/MDR1b)
- Potassium voltage-gated channel subfamily H member 2
- Sodium channel protein type 5 subunit alpha
- Transcriptional activator protein luxR
- Voltage-dependent L-type calcium channel subunit alpha-1C
| - (+/-)1-(4-tert-butylphenyl)-4-(4-(hydroxydiphenylmethyl)piperidin-1-yl)butan-1-ol
- 1-(4-tert-Butyl-phenyl)-4-[4-(hydroxy-diphenyl-methyl)-piperidin-1-yl]-butan-1-ol
- 1-(4-tert-Butyl-phenyl)-4-[4-(hydroxy-diphenyl-methyl)-piperidin-1-yl]-butan-1-ol(Terfenadine)
- 1-(4-tert-butylphenyl)-4-(4-(hydroxydiphenylmethyl)piperidin-1-yl)butan-1-ol
- CHEMBL17157
- TERFENADINE
- teraenadine
|
BDBM50018958
 | 24 | 0 | 0 | 25 | 0 | 0 | 0 | 0 | - 5-hydroxytryptamine receptor 2A
- Beta-2 adrenergic receptor and beta-3 adrenergic receptor
- D(1A) dopamine receptor
- D(2) dopamine receptor
- D(3) dopamine receptor
- Dopamine D2 receptor and Serotonin 2a receptor (D2 and 5HT2a)
- Dopamine receptor D2L/neurotensin receptor NTS1
- Dopamine receptors; D1 & D2
- Dopamine receptors; D2 & D4
| |
BDBM50153588
 | 0 | 49 | 0 | 0 | 0 | 0 | 0 | 0 | - Amine oxidase [flavin-containing] A
- Amine oxidase [flavin-containing] B
- GST-Lysine-specific histone demethylase 1A (LSD1)
- Lysine-specific histone demethylase 1A
| - CHEMBL3775480
- US10053456, 119
- US9487511, 84
- US9718814, 84
|
BDBM50157881
 | 0 | 49 | 0 | 0 | 0 | 0 | 0 | 0 | - 1,3-beta-glucan synthase component GLS2
- 3-phosphoinositide dependent protein kinase-1
- ALK tyrosine kinase receptor
- Aurora kinase A
- Cyclin-Dependent Kinase 4 (CDK4)
- Cyclin-dependent kinase 2
- Ephrin receptor
- Epidermal growth factor receptor
- Fibroblast growth factor receptor 4
- Hepatocyte growth factor receptor
- Insulin receptor
- Insulin-like growth factor I receptor
- MAP kinase-activated protein kinase 2
- MAP kinase-activated protein kinase 5
- Mast/stem cell growth factor receptor Kit
- Mitogen-activated protein kinase 1
- Mitogen-activated protein kinase 14
- Mitogen-activated protein kinase kinase kinase 8
- Non-receptor tyrosine-protein kinase TYK2
- Phosphatidylinositol 3-kinase catalytic subunit type 3
- Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
- Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform
- Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform/gamma isoform
- Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
- Phosphatidylinositol 4-kinase beta
- Platelet-derived growth factor receptor
- Proto-oncogene tyrosine-protein kinase receptor Ret
- Receptor tyrosine-protein kinase erbB-2
- Tyrosine-protein kinase BTK
- Tyrosine-protein kinase JAK1
- Tyrosine-protein kinase JAK2
- Tyrosine-protein kinase JAK3
- Tyrosine-protein kinase Lck
- Tyrosine-protein kinase SYK
- Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)
- cAMP-dependent protein kinase (PKA)
| |
BDBM81774
 | 43 | 6 | 0 | 0 | 0 | 0 | 0 | 0 | - Alpha-1 Adrenergic Receptor/ adrenergic receptor/ adrenergic receptor
- D(2) dopamine receptor
- D(3) dopamine receptor
- DOPAMINE
- DRD1
- DRD2
- Dopamine D1 receptor
- Dopamine D2 receptor
- Dopamine D2 receptor and Serotonin 2a receptor (D2 and 5HT2a)
- Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor
- Dopamine receptor
- Dopamine receptors; D2 & D4
- Myeloperoxidase
- Serotonin (5-HT) receptor
- Serotonin 1 (5-HT1) receptor
- Serotonin 2 (5-HT2) receptor
| - CAS_15676-16-1
- SULPIRIDE,(+)
- Sulpiride-S
- Sulpiride-l
|
BDBM92862
 | 2 | 47 | 0 | 0 | 0 | 0 | 0 | 0 | - Mammalian target of Rapamycin (mTORC1)
- Peptidyl-prolyl cis-trans isomerase FKBP1B/Serine/threonine-protein kinase mTOR
- Phosphatidylinositol 3-kinase catalytic subunit type 3
- Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
- Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform
- Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform/gamma isoform
- Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
- Phosphatidylinositol 4-phosphate 3-kinase C2 domain-containing subunit alpha
- Phosphatidylinositol 4-phosphate 3-kinase C2 domain-containing subunit beta
- Phosphoinositide 3-Kinase (PI3K), delta
- Phosphoinositide 3-Kinase (PI3K), gamma
- Serine-protein kinase ATM
- Tyrosine-protein kinase JAK3
- p110α/p85α
- p110β/p85α
| - US9284315, BEZ-235
- mTOR Inhibitor, BEZ235
|
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