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Compounds Sorted by Binding Targets per Compound

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64   65   66   67   68   69   70   73   74   75   76   77   79   81   84   86   89   95   96   100   108   
109   120   124   130   137   143   154   156   168   186   224   237   259   276   278   284   303   304   310   314   323   
339   369   370   371   372   373   374   375   376   377   378   380   381   383   384   385   386   387   388   389   391   
393   394   395   397   401   402   405   407   417   418   427   428   442   445   512   
Compounds Sorted Alphabetically
Compound Name
(alphabetical)
Binding TargetsEnz. Inhib. DataITC DataAlternate Compound Names
KiIC50KdEC50KoffKonOther
BDBM13063
PNG
  • β-Carbonic anhydrase 2 (CA 2)
  • Alpha carbonic anhydrase
  • Astrosclerin-3
  • Bile salt export pump
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Carbonate dehydratase
  • Carbonic Anhydrase (mtCA 1)
  • Carbonic Anhydrase (mtCA 3)
  • Carbonic Anhydrase 2 (Can2)
  • Carbonic Anhydrase III
  • Carbonic Anhydrase IV
  • Carbonic Anhydrase VA
  • Carbonic Anhydrase VB
  • Carbonic Anhydrase XIII
  • Carbonic Anhydrase XIV
  • Carbonic Anhydrase XV
  • Carbonic anhydrase
  • Carbonic anhydrase 1
  • Carbonic anhydrase 12
  • Carbonic anhydrase 13 (CA XIII)
  • Carbonic anhydrase 2
  • Carbonic anhydrase 4
  • Carbonic anhydrase 6 (CA-VI)
  • Carbonic anhydrase 7
  • Carbonic anhydrase 9
  • Carbonic anhydrase, alpha family
  • Carbonic anhydrases; II & IX
  • Cyclooxygenase
  • Cyclooxygenase-1 (COX-1)
  • Cytochrome c oxidase subunit 1
  • Cytochrome c oxidase subunit 2
  • Delta carbonic anhydrase
  • GTP-binding protein (rab7)
  • Gamma-carbonic anhydrase
  • Multidrug resistance-associated protein 4
  • PROBABLE TRANSMEMBRANE CARBONIC ANHYDRASE (CARBONATE DEHYDRATASE) (CARBONIC DEHYDRATASE)
  • Prostaglandin E synthase/G/H synthase 2
  • Prostaglandin G/H synthase (cyclooxygenase)
  • Ras-related C3 botulinum toxin substrate 1
  • Ras-related protein Rab-2A.
  • beta-Carbonic Anhydrase
  • cell division cycle 42 (GTP binding protein, 25kDa)
  • ras protein
12131080000
  • 4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)benzene-1-sulfonamide
  • Bextra
  • CHEMBL865
  • VLX
  • Valdecoxib
  • cid_119607
BDBM27344
PNG
  • ALK tyrosine kinase receptor
  • Aurora kinase A/Targeting protein for Xklp2
  • Aurora kinase B
  • Axin-1/Glycogen synthase kinase-3 beta
  • Cdc7 Kinase
  • Cell division cycle 7-related protein kinase
  • Cyclin-dependent kinase 1
  • Cyclin-dependent kinase 2
  • Cyclin-dependent kinase 7
  • Cyclin-dependent kinase 9
  • Cyclin-dependent-like kinase 5
  • Fibroblast growth factor receptor 1
  • Hepatocyte growth factor receptor
  • High affinity nerve growth factor receptor
  • Inhibitor of nuclear factor kappa-B kinase subunit beta
  • Insulin receptor
  • MAP kinase-activated protein kinase 2
  • MAP kinase-activated protein kinase 3
  • MAP kinase-activated protein kinase 5
  • MAP kinase-interacting serine/threonine-protein kinase 1
  • MAP kinase-interacting serine/threonine-protein kinase 2
  • Mast/stem cell growth factor receptor Kit
  • Mitogen-activated protein kinase 1
  • Mitogen-activated protein kinase 11
  • PKC alpha and beta-2
  • Proto-oncogene tyrosine-protein kinase receptor Ret
  • RAC-alpha serine/threonine-protein kinase
  • Ribosomal protein S6 kinase alpha 4
  • Ribosomal protein S6 kinase alpha 5
  • Serine/threonine-protein kinase 2
  • Serine/threonine-protein kinase CHK2
  • Serine/threonine-protein kinase Chk1/2
  • Serine/threonine-protein kinase NEK6
  • Serine/threonine-protein kinase NIM1
  • Serine/threonine-protein kinase PAK 4
  • Serine/threonine-protein kinase PLK1
  • Serine/threonine-protein kinase TAO3
  • Tyrosine-protein kinase ABL1
  • Tyrosine-protein kinase Lck
  • Tyrosine-protein kinase ZAP-70
  • Vascular endothelial growth factor receptor 2
  • Vascular endothelial growth factor receptor 3
  • [Pyruvate dehydrogenase (acetyl-transferring)] kinase isozyme 1, mitochondrial
  • cAMP-dependent protein kinase (PKA)
048000000
  • 2-(pyridin-4-yl)-1H,4H,5H,6H,7H-pyrrolo[3,2-c]pyridin-4-one
  • JMC502647 Compound 8
  • Pyrrolopyridinone, 1
BDBM29525
PNG
  • 5-hydroxytryptamine receptor 2A
  • 5-hydroxytryptamine receptor 2B
  • 5-hydroxytryptamine receptor 2C
  • 5-hydroxytryptamine receptor 3A
  • 5-hydroxytryptamine receptor 4 (5-HT4)
  • Adenosine Receptors A2a (A2a)
  • Adenosine receptor A1
  • Alpha-1A adrenergic receptor
  • BDKRB1
  • Beta-1 adrenergic receptor
  • Beta-2 adrenergic receptor
  • Bombesin
  • CCKBR
  • CGRP
  • D(1A) dopamine receptor
  • D(2) dopamine receptor
  • Endothelin-converting enzyme 1 (ECE)
  • GALANIN
  • Gamma-aminobutyric acid receptor subunit alpha-1
  • Gamma-aminobutyric acid type B receptor subunit 1
  • Glutamate receptor ionotropic, NMDA 1
  • Glycine
  • HRH3
  • HTR2C
  • HTR4
  • Histamine H1 receptor
  • Kappa-type opioid receptor
  • Mu-type opioid receptor
  • Muscarinic acetylcholine receptor M1
  • Muscarinic acetylcholine receptor M2
  • Muscarinic acetylcholine receptor M3
  • Neurokinin 1 receptor
  • Neurokinin 2 receptor
  • Neurokinin 3 receptor
  • Neuropeptide Y
  • SOMATOSTATIN
  • Serotonin (5-HT) receptor
  • Serotonin 3a (5-HT3a)/3b (5-HT3b) receptor
  • Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
  • VASOPRESSIN V1
  • VIP
  • Vasopressin V2 Receptor
  • adrenergic Alpha2
  • n-AChR
893100000
  • 3H-GR113808
  • CHEMBL518682
  • GR 113808
  • [3H] GR 113808
  • [3H]GR113808
BDBM50009001
PNG
  • 1-deoxy-D-xylulose 5-phosphate reductoisomerase
  • 12-Lipoxygenase (12-LOX)
  • 15-Lipoxygenase-2 (15-LOX-2)
  • 17-beta-hydroxysteroid dehydrogenase type 3
  • 5-hydroxytryptamine receptor 7
  • Arachidonate 12-lipoxygenase
  • Arachidonate 15-lipoxygenase
  • Arachidonate 15-lipoxygenase, type II
  • Arachidonate 5-lipoxygenase
  • Aurora kinase B
  • Casein kinase II subunit alpha 3
  • Cyclin-dependent kinase 1
  • Cyclooxygenase
  • Cytochrome P450 1A1
  • Cytochrome P450 1B1
  • Cytochrome P450 3A
  • Death-associated protein kinase 1
  • Dipeptidyl peptidase 4
  • Fructose-1,6-bisphosphatase
  • G protein-coupled receptor kinase 6
  • G-protein coupled receptor 35
  • Gamma-amino-N-butyrate transaminase
  • Glyoxalase 1 (GLO1)
  • Histone Lysine Demethylase
  • Human immunodeficiency virus type 1 integrase
  • Lipoxygenase
  • Lipoxygenase-1
  • Lysine-specific histone demethylase 1A
  • Lysosomal alpha-glucosidase
  • P-glycoprotein 1
  • Prolyl endopeptidase
  • Prostaglandin G/H synthase (cyclooxygenase)
  • Receptor-type tyrosine-protein phosphatase S
  • Replicase polyprotein 1ab
  • Sialidase 2
  • Sucrase-isomaltase
  • Trypsin
  • Tyrosine-protein kinase receptor FLT3
  • Urease subunit beta
  • Uridine-5'-diphosphoglucuronosyltransferase 1A1
  • VHL/Tyrosine-protein kinase Yes
  • Xanthine dehydrogenase
  • Xanthine dehydrogenase/oxidase
  • alpha-Glucosidase (α-Glucosidase)
557030000
  • 5,6,7-Trihydroxyflavone
  • 5,6,7-trihydroxy-2-phenyl-4H-chromen-4-one
  • Baicalein
  • Baicalein, 14
  • Baicalein, 8
  • CHEMBL8260
  • US10252984, Table 2.33
BDBM50022815
PNG
  • ATP-binding cassette sub-family G member 2
  • Bile acid transporter
  • Bile salt export pump
  • Bile salt export pump (BSEP)
  • Canalicular multispecific organic anion transporter 1
  • Canalicular multispecific organic anion transporter 2
  • Cyclophilin B (CypB)
  • Cyclophilin D (CypD)
  • Cytochrome P450 1A
  • Cytochrome P450 2C19
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6 (2D6)
  • Cytochrome P450 3A
  • Dihydroorotate dehydrogenase
  • FK506 binding protein 4
  • FK506-binding protein 1B
  • Human immunodeficiency virus type 1 reverse transcriptase
  • Ileal bile acid transporter/bile acid cotransporter
  • Interleukin-2
  • Multidrug resistance protein 1/Multidrug resistance associated protein 1
  • Multidrug resistance-associated protein 2 (MRP2)
  • Multidrug resistance-associated protein 4
  • Organic anion-transporting polypeptide 1D1 (Oatp1d1)
  • P-glycoprotein (P-gp)
  • P-glycoprotein 1
  • P-glycoprotein 1 and 3 (MDR1a/MDR1b)
  • Peptidyl-prolyl cis-trans isomerase A
  • Peptidyl-prolyl cis-trans isomerase D
  • Peptidyl-prolyl cis-trans isomerase FKBP1A
  • Phosphatidylinositol 3-kinase p110γ (p110γ)
  • Replicase polyprotein 1ab
  • Sarcoplasmic/endoplasmic reticulum calcium ATP-ase
  • Serine/threonine-protein phosphatase 2B catalytic subunit gamma isoform
  • Solute carrier organic anion transporter family member 1B1 (OATP1B1)
  • Solute carrier organic anion transporter family member 1B3 (OATP1B3)
  • Solute carrier organic anion transporter family member 2B1
  • Uridine-5'-diphosphoglucuronosyltransferase 1A1
  • Uridine-5'-diphosphoglucuronosyltransferase 1A4
  • Uridine-5'-diphosphoglucuronosyltransferase 1A6
  • Uridine-5'-diphosphoglucuronosyltransferase 2B10
  • Uridine-5'-diphosphoglucuronosyltransferase 2B7
  • Voltage-dependent L-type calcium channel subunit alpha-1C
  • calcineurin
  • fMet-Leu-Phe receptor
4210717100000
  • (3S,6S,9S,12R,15S,18S,21S,24S,30S,33S)-30-ethyl-33-[(1R,2R,4E)-1-hydroxy-2-methylhex-4-en-1-yl]-1,4,7,10,12,15,19,25,28-nonamethyl-6,9,18,24-tetrakis(2-methylpropyl)-3,21-bis(propan-2-yl)-1,4,7,10,13,16,19,22,25,28,31-undecaazacyclotritriacontan-2,5,8,11,14,17,20,23,26,29,32-undecone
  • 30-Ethyl-33-((E)-1-hydroxy-2-methyl-hex-4-enyl)-6,9,18,24-tetraisobutyl-3,21-diisopropyl-1,4,7,10,12,15,19,28-octamethyl-1,4,7,10,13,16,19,22,25,28,31undecaaza-cyclotritriacontan-2,5,8,11,14,17,20,23,26,29,32-undecaone
  • 30-Ethyl-33-(1-hydroxy-2-methyl-hex-4-enyl)-6,9,18,24-tetraisobutyl-3,21-diisopropyl-1,4,7,10,12,15,19,25,28-nonamethyl-1,4,7,10,13,16,19,22,25,28,31undecaaza-cyclotritriacontan-2,5,8,11,14,17,20,23,26,29,32-undecaone
  • CYCLOSPORINE
  • Cyclosporin A
  • Cyclosporine A
  • Cyclosproine A
  • US10077289, Compound Cyclosporin A
  • US9138393, Cyclosporin A
BDBM50148911
PNG
  • 11-beta-hydroxysteroid dehydrogenase 1
  • 15-Lipoxygenase-2 (15-LOX-2)
  • 5-lipoxygenase/FLAP
  • Aldo-keto reductase family member 1B10 (AKR1B10)
  • Aldose reductase (AR)
  • Alpha glucosidase
  • Cathepsin D
  • Cholesteryl ester transfer protein
  • Cyclooxygenase
  • Cyclooxygenase-1 (COX-1)
  • Cytochrome P450 19A1
  • DNA Ligase I
  • DNA polymerase beta
  • Fatty acid synthase
  • G-protein coupled bile acid receptor 1
  • GP41
  • Glycogen phosphorylase, muscle form
  • Hemagglutinin
  • Histidine-rich protein
  • Hypoxia-inducible factor prolyl hydroxylase
  • Leukocyte elastase
  • Low molecular weight phosphotyrosine protein phosphatase
  • Nuclear factor NF-kappa-B
  • Nuclear receptor ROR-gamma (RORC)
  • Pancreatic alpha-amylase
  • Peroxisome proliferator-activated receptor alpha (PPAR alpha)
  • Phospholipase A2
  • Phospholipase A2 isozyme DE-I
  • Phospholipase A2 isozyme PLA-A
  • Prostaglandin E synthase/G/H synthase 2
  • Prostaglandin G/H synthase (cyclooxygenase)
  • Protease
  • Protein-tyrosine phosphatase 1B
  • Protein-tyrosine phosphatase 1C
  • Protein-tyrosine phosphatase alpha
  • Receptor-type tyrosine-protein phosphatase F (LAR)
  • Receptor-type tyrosine-protein phosphatase epsilon (PTPε)
  • Solute carrier organic anion transporter family member 1B1 (OATP1B1)
  • Solute carrier organic anion transporter family member 1B3 (OATP1B3)
  • Tyrosine-protein phosphatase non-receptor type 2
  • Ubiquitin carboxyl-terminal hydrolase 47
  • Ubiquitin carboxyl-terminal hydrolase 7
  • alpha-Glucosidase (α-Glucosidase)
  • von Hippel-Lindau disease tumor suppressor/Elongin-C/Elongin-B/HIF1A
398250000
  • (3beta)-3-hydroxyurs-12-en-28-oic acid
  • 3beta-hydroxyurs-12-en-28-oic acid
  • CHEMBL169
  • Ursolic acid
  • malol
  • prunol
  • urson
BDBM50215552
PNG
  • 5-hydroxytryptamine receptor 1A
  • 5-hydroxytryptamine receptor 1B
  • 5-hydroxytryptamine receptor 1D
  • 5-hydroxytryptamine receptor 2A
  • 5-hydroxytryptamine receptor 2B
  • 5-hydroxytryptamine receptor 2C
  • 5-hydroxytryptamine receptor 5A
  • 5-hydroxytryptamine receptor 6
  • 5-hydroxytryptamine receptor 7
  • Adrenergic alpha1B
  • Alpha-1A adrenergic receptor
  • Alpha-2A adrenergic receptor
  • Alpha-2B adrenergic receptor
  • Alpha-2C adrenergic receptor
  • Beta-1 adrenergic receptor
  • Beta-2 adrenergic receptor
  • D(1A) dopamine receptor
  • D(1B) dopamine receptor
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • D(4) dopamine receptor
  • Delta-type opioid receptor
  • GRM8
  • Histamine H1 receptor
  • Histamine H2 Receptor
  • Histamine H3 receptor
  • Histamine H4 receptor
  • Kappa-type opioid receptor
  • Metabotropic glutamate receptor
  • Metabotropic glutamate receptor 1
  • Metabotropic glutamate receptor 2
  • Metabotropic glutamate receptor 4 (mGluR4)
  • Metabotropic glutamate receptor 6
  • Mu-type opioid receptor
  • Muscarinic acetylcholine receptor M1
  • Muscarinic acetylcholine receptor M2
  • Muscarinic acetylcholine receptor M3
  • Muscarinic acetylcholine receptor M4
  • Muscarinic acetylcholine receptor M5
  • Serotonin (5-HT) receptor
  • Sigma non-opioid intracellular receptor 1
  • Sodium-dependent dopamine transporter
  • Sodium-dependent noradrenaline transporter
  • Sodium-dependent serotonin transporter
442000000
  • 3-fluoro-5-(2-(2-(fluoromethyl)thiazol-4-yl)ethynyl)benzonitrile
  • CHEMBL229429