Compound Name (alphabetical) | Enz. Inhib. Data | ITC Data | Binding Targets | Alternate Compound Names |
---|
Ki | IC50 | Kd | EC50 | Koff | Kon | Other |
---|
BDBM14487
| 33 | 22 | 4 | 28 | 0 | 0 | 0 | 0 | - ADORA3
- Adenosine A1 receptor
- Adenosine A2 receptor
- Adenosine Receptors A2a (A2a)
- Adenosine deaminase
- Adenosine kinase
- Adenosine receptor A1
- Adenosine receptor A2
- Adenosine receptor A2a and A3
- Adenosine receptor A2b
- Adenosine receptor A3
- Adenylate cyclase type V
- Adenylate kinase 1
- Adenylate kinase 2
- CaM kinase I alpha
- Epidermal growth factor receptor
- Equilibrative Nucleoside Transporter 1 (ENT1)
- Equilibrative nucleoside transporter 2
- Genome polyprotein
- Glyceraldehyde-3-phosphate dehydrogenase liver
- Glycogen synthase kinase-3 beta
- Heat Shock 70kDa Protein 1
- Histone-lysine N-methyltransferase, H3 lysine-79 specific
- Inosine Monophosphate Dehydrogenase Type 1 (IMPDH1)
- Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)
- PKC alpha and beta-2
- Phosphatidylinositol 4-kinase type 2-alpha
- Purine nucleoside phosphorylase
- Sodium/nucleoside cotransporter 1
- Sodium/nucleoside cotransporter 2
- Solute carrier family 28 member 3
- TAK1/TAB1
- heat shock 70kDa protein 8 isoform 1
| - (2R,3R,4S,5R)-2-(6-amino-9H-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
- Adenine-beta-D-arabinofuranoside
- Adenosine
- CHEMBL477
- N6-Methylado
- [U-14C]adenosine
- cid_191
- cid_60961
|
BDBM18525
| 21 | 59 | 0 | 7 | 0 | 0 | 0 | 0 | - Androgen Receptor
- Androgen receptor
- Bile salt export pump
- Estrogen receptor
- Glucocorticoid
- Progesterone Receptor (PR)
- Progesterone receptor
- mineralocorticoid
| - Bicalutamide
- CHEMBL409
- N-[4-cyano-3-(trifluoromethyl)phenyl]-3-[(4-fluorobenzene)sulfonyl]-2-hydroxy-2-methylpropanamide
- US9126941, Bicalutamide
- US9682960, CAS
|
BDBM50005548
| 68 | 19 | 0 | 0 | 0 | 0 | 0 | 0 | - 5-HT3A Serotonin Receptor
- 5-hydroxytryptamine receptor 1A (5-HT1A)
- Adrenergic receptor beta
- Alpha-1A adrenergic receptor
- Bile salt export pump
- Bile salt export pump (BSEP)
- Cytochrome P450 2D6 (2D6)
- D(1A) dopamine receptor
- D(2) dopamine receptor
- DOPAMINE
- Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor
- Dopamine Transporter (DAT)
- Dopamine receptor
- Gamma-aminobutyric acid receptor subunit alpha-1 (GABA(A) alpha-1)
- Histamine H1 receptor
- Monoamine transporters; Norepininephrine & dopamine
- Monoamine transporters; serotonin & dopamine
- Muscarinic acetylcholine receptor M2
- Norepinephrine Monoamine transporters
- Norepinephrine transporter
- Potassium voltage-gated channel subfamily H member 2
- Serotonin (5-HT) receptor
- Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
- Sodium-dependent noradrenaline transporter
- Sodium-dependent serotonin transporter
- Transporter
- adrenergic Alpha2
| - (+)-2-Methyl-4-phenyl-1,2,3,4-tetrahydro-isoquinolin-8-ylamine
- (+/-)-2-Methyl-4-phenyl-1,2,3,4-tetrahydro-isoquinolin-8-ylamine
- (-)-2-Methyl-4-phenyl-1,2,3,4-tetrahydro-isoquinolin-8-ylamine
- (Nomifensine) 2-Methyl-4-phenyl-1,2,3,4-tetrahydro-isoquinolin-8-ylamine
- 2-Methyl-4-phenyl-1,2,3,4-tetrahydro-isoquinolin-8-ylamine
- 2-Methyl-4-phenyl-1,2,3,4-tetrahydro-isoquinolin-8-ylamine (Nomifensine)
- 2-Methyl-4-phenyl-1,2,3,4-tetrahydro-isoquinolin-8-ylamine(Nomifensine)
- 2-methyl-4-phenyl-1,2,3,4-tetrahydroisoquinolin-8-amine
- CHEMBL273575
- NOMIFENSINE
- NOMIFENSINE2-Methyl-4-phenyl-1,2,3,4-tetrahydro-isoquinolin-8-ylamine
|
BDBM50022784
| 79 | 8 | 0 | 0 | 0 | 0 | 0 | 0 | - 5-Hydroxytryptamine receptor 6 (5-HT6)
- 5-Hydroxytryptamine receptor 7 (5-HT7)
- 5-hydroxytryptamine receptor 1A (5-HT1A)
- 5-hydroxytryptamine receptor 1B
- 5-hydroxytryptamine receptor 1D
- 5-hydroxytryptamine receptor 2A
- 5-hydroxytryptamine receptor 2C
- 5-hydroxytryptamine receptor 3A
- ADENOSINE A2
- ADRA2B
- ADRB2
- Adenosine receptor A1
- Adenosine transporter
- Adenylate cyclase Forskolin
- Adrenergic receptor beta
- Alpha adrenergic receptor 1A and 1B
- Alpha-1A adrenergic receptor
- Alpha-2A adrenergic receptor
- Calcium channel (Type T,L)
- Cholecystokinin receptor
- Cytochrome P450 2D6 (2D6)
- D(2) dopamine receptor
- DOPAMINE
- Dopamine Transporter (DAT)
- Ecto-5'-nucleotidase (e5'NT)
- GABA A
- GRIA3
- Gamma-aminobutyric acid receptor subunit alpha-1 (GABA(A) alpha-1)
- Gamma-aminobutyric acid type B receptor subunit 1
- Glutamate kainate
- Glycine receptor subunit alpha-1
- Glycine, non-strychnine
- HTR4
- Histamine H1 receptor
- Histamine H2 receptor
- Inositol Triphosphate
- Ionotropic glutamate receptor NMDA 1/2D
- Kappa-type opioid receptor
- Melatonin receptor
- Monoamine transporters; serotonin & dopamine
- Muscarinic acetylcholine receptor M1
- Muscarinic acetylcholine receptor M2
- Neurokinin 1 receptor
- Neurokinin 3 receptor
- Neuropeptide Y receptor type 1
- Nitric-oxide synthase, brain
- Nociceptin receptor
- Nociceptin/mu opioid receptor
- Norepinephrine transporter
- Opioid receptors; mu & delta
- Potassium Channel
- Protein kinase C
- Renal Outer Medullary Potassium (ROMK)
- SOMATOSTATIN
- Sigma non-opioid intracellular receptor 1
- Sodium (Site 1)
- Sodium (Site 2)
- Sodium-dependent noradrenaline transporter
- Sodium-dependent serotonin transporter
- TACR2
- Voltage-dependent N-type calcium channel subunit alpha-1B
- adrenergic Alpha2
- alpha-1 Nicotinic AChR
| - (R)-N-methyl-3-phenyl-3-(o-tolyloxy)propan-1-amine
- ATOMOXETINE
- CHEMBL641
- Methyl-((R)-3-phenyl-3-o-tolyloxy-propyl)-amine
- Methyl-(3-phenyl-3-o-tolyloxy-propyl)-amine
- Methyl-(3-phenyl-3-o-tolyloxy-propyl)-amine(tomoxetine)
- Strattera
- Tomoxetine
|
BDBM50094703
| 77 | 10 | 0 | 0 | 0 | 0 | 0 | 0 | - ADRB2
- AGTR1
- ATPase (Na+, K+)
- AVPR1A
- Adenosine Kinase (AK)
- Adenosine kinase
- Adrenergic receptor beta
- Alpha-1A adrenergic receptor
- Angiotensin II AT2
- BDKRB2
- Benzodiazepine central
- Bombesin
- CCKBR
- CGRP
- CHRM5
- COX-1
- COX-2
- Calcium channel
- Calcium channel (DHP)
- Calcium release-activated calcium channel
- Cannabinoid receptor 1
- Cannabinoid receptor 2
- Chloride channel, TBOB
- DOPAMINE
- Dopamine D1B
- Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor
- Dopamine Transporter (DAT)
- Dopamine receptor
- EDNRA
- EDNRB
- Ecto-5'-nucleotidase (e5'NT)
- GALANIN
- GRIA3
- Gamma-aminobutyric acid type B receptor subunit 1
- Glutamate kainate
- HTR5A
- HTR6
- Histamine H1 receptor
- Histamine H2 receptor
- Interleukin 1-Alpha
- Ionotropic glutamate receptor NMDA 1/2D
- Kappa-type opioid receptor
- Melatonin
- Monoamine Oxidase Type B (MAO-B)
- Muscarinic acetylcholine receptor M1
- Muscarinic acetylcholine receptor M2
- Muscarinic acetylcholine receptor M3
- Muscarinic acetylcholine receptor M4
- NPY2R
- Neurokinin 1 receptor
- Neurokinin 3 receptor
- Neuronal acetylcholine receptor
- Neuropeptide Y
- Nociceptin/mu opioid receptor
- Norepinephrine transporter
- Opioid receptors; mu & delta
- PDGF
- PTGIR
- Potassium Channel
- Potassium Channel (Ca2+ dependent)
- Renal Outer Medullary Potassium (ROMK)
- SOMATOSTATIN
- Serotonin (5-HT) receptor
- Serotonin 1B/1D receptor
- Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
- Sigma non-opioid intracellular receptor 1
- Sodium (Site 1)
- Sodium (Site 2)
- TACR2
- TNF-alpha
- Thromboxane A2 receptor
- VIP
- Vasopressin V2 Receptor
- adrenergic Alpha2
| - 5-(3-Bromo-phenyl)-7-(6-morpholin-4-yl-pyridin-3-yl)-pyrido[2,3-d]pyrimidin-4-ylamine
- 5-(3-bromophenyl)-7-(6-morpholin-4-ylpyridin-3-yl)pyrido[2,3-d]pyrimidin-4-ylamine
- ABT-702
- CHEMBL66089
|
BDBM50357312
| 1 | 86 | 0 | 0 | 0 | 0 | 0 | 0 | - Epidermal growth factor receptor
- Fibroblast growth factor receptor 2
- Proto-oncogene tyrosine-protein kinase Src
- Proto-oncogene tyrosine-protein kinase receptor Ret
- Receptor tyrosine-protein kinase erbB-2
- Receptor tyrosine-protein kinase erbB-4
- Redox-regulatory protein FAM213A
- SRC
- Tyrosine-protein kinase ABL1
- Tyrosine-protein kinase BMX
- Tyrosine-protein kinase BRK
- Tyrosine-protein kinase BTK
- Tyrosine-protein kinase Blk
- Tyrosine-protein kinase CSK
- Tyrosine-protein kinase FER
- Tyrosine-protein kinase ITK/TSK
- Tyrosine-protein kinase JAK3
- Tyrosine-protein kinase Lck
- Tyrosine-protein kinase Lyn
- Tyrosine-protein kinase SYK
- Tyrosine-protein kinase TEC
- Tyrosine-protein kinase Yes
| - IBRUTINIB
- PCI-32765
- US10124003, Ref. Ex. Compound 1
- US9108973, Ref 1
- US9181263, 1
- US9278100, 1
|
BDBM8611
| 4 | 83 | 0 | 0 | 0 | 0 | 0 | 0 | - Aromatase (CYP19)
- Cytochrome P450 11B
- Cytochrome P450 11B1
- Cytochrome P450 11B1, mitochondrial
- Cytochrome P450 11B2
- Cytochrome P450 11B2 (CYP11B2)
- Cytochrome P450 11B2, mitochondrial
- Cytochrome P450 17A1
- Cytochrome P450 19A1
| - 4-{5H,6H,7H,8H-imidazo[1,5-a]pyridin-5-yl}benzonitrile
- CHEMBL468419
- CHEMBL9298
- Fadrozole
- US9271963, Fadrozole
|
BDBM86231
| 86 | 1 | 0 | 0 | 0 | 0 | 0 | 0 | - Alpha-1A adrenergic receptor
- CHRM4
- CHRM5
- Cholinergic, muscarinic
- DRD1
- Histamine H1 receptor
- Muscarinic acetylcholine receptor M1
- Muscarinic acetylcholine receptor M2
- Muscarinic acetylcholine receptor M3
- Muscarinic acetylcholine receptor M4
- n-AChR
| - ATR
- ATROPINE
- Atropine,(-)
- CAS_51-55-8
- CHEMBL195
- NSC_3661
- US9333195, ATROPINE
|