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Compounds Sorted by Binding Data per Compound

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64   65   66   67   68   69   70   71   72   73   74   75   76   77   78   79   80   81   82   83   84   
85   86   87   88   89   90   91   92   93   94   95   96   97   98   99   100   101   102   103   104   105   
108   109   110   111   112   113   114   116   117   118   119   120   122   123   124   125   126   127   128   129   130   
131   132   133   135   136   137   138   139   140   141   143   145   146   147   148   150   151   152   153   154   156   
157   158   159   160   162   164   165   168   169   170   171   173   178   183   186   188   190   194   195   202   203   
207   208   210   217   220   222   223   224   230   232   239   241   248   255   259   277   285   288   289   297   303   
304   306   308   310   329   330   333   335   336   337   355   360   364   381   389   411   442   443   444   445   446   
448   450   453   454   455   456   457   459   460   461   463   464   465   467   481   492   497   500   508   511   523   
527   536   538   581   730   790   804   821   824   829   831   832   836   838   847   848   853   855   864   865   880   
913   923   928   938   943   960   988   989   991   1004   1027   1046   1094   1125   1196   1336   1370   1421   1584   
Compounds Sorted Alphabetically
Compound Name
(alphabetical)
Enz. Inhib. DataITC DataBinding TargetsAlternate Compound Names
KiIC50KdEC50KoffKonOther
BDBM19264
PNG
2221110000
  • Inosine Monophosphate Dehydrogenase Type 1 (IMPDH1)
  • Inosine Monophosphate Dehydrogenase Type 2 (IMPDH2)
  • Inosine-5'-monophosphate dehydrogenase (IMPDH)
  • Peroxisome proliferator-activated receptor
  • Uridine-5'-diphosphoglucuronosyltransferase 2B7
  • (4E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1,3-dihydro-2-benzofuran-5-yl)-4-methylhex-4-enoic acid
  • (E)-6-(4-hydroxy-6-methoxy-7-methyl-3-oxo-1H-2-benzofuran-5-yl)-4-methylhex-4-enoic acid
  • CHEMBL866
  • MPA (1)
  • Mycophenolic Acid (MPA)
  • Myfortic
BDBM22984
PNG
539100000
  • Anti-estrogen binding site (AEBS)
  • Aurora kinase A
  • Bacteriophage T4 DNA Ligase
  • CAM-RNase A
  • CDGSH iron-sulfur domain-containing protein 1
  • Carnitine palmitoyltransferase 1A
  • Carnitine palmitoyltransferase 2
  • Collagenase
  • DNA Ligase (MtuLigA)
  • DNA primase (Ba DnaG)
  • DNA primase (Mtb DnaG)
  • DNA topoisomerase
  • DNA topoisomerase 1
  • DNA topoisomerase I
  • DNA topoisomerase I (Topo I)
  • Deoxyribonuclease-1
  • Deoxyribonuclease-2-alpha
  • Human immunodeficiency virus type 1 integrase
  • Multidrug resistance-associated protein 1
  • Purinergic receptor P2Y12
  • Receptor tyrosine-protein kinase erbB-2
  • 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
  • Telomerase reverse transcriptase
  • Topoisomerase II alpha (HuTopoIIα)
  • Type-2 restriction enzyme BamHI
  • Type-2 restriction enzyme EcoRI
  • Type-2 restriction enzyme HindIII
  • Type-2 restriction enzyme PstI
  • Type-2 restriction enzyme ScaI
  • (8S,10S)-10-{[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy}-6,8,11-trihydroxy-8-(2-hydroxyacetyl)-1-methoxy-5,7,8,9,10,12-hexahydrotetracene-5,12-dione
  • Adriamycin
  • Adriblastina
  • CHEMBL53463
  • Doxil
  • Doxorubicin
BDBM26991
PNG
450000000
  • α-Carbonic anhydrase (αCA)
  • β-Carbonic anhydrase (βCA)
  • Alpha carbonic anhydrase
  • Alpha-carbonic anhydrase
  • Astrosclerin-3
  • Beta-carbonic anhydrase
  • Carbonic Anhydrase XIII
  • Carbonic Anhydrase XV
  • Carbonic anhydrase
  • Carbonic anhydrase 1
  • Carbonic anhydrase 2
  • Carbonic anhydrase 4
  • Carbonic anhydrase 6 (CA-VI)
  • Carbonic anhydrase 7
  • Gamma-carbonic anhydrase
  • CHEMBL1689285
  • HSO3-
  • bisulfite
  • hydrogen sulfite
BDBM28583
PNG
396000000
  • 5-Hydroxytryptamine receptor 6 (5-HT6)
  • 5-Hydroxytryptamine receptor 7 (5-HT7)
  • 5-hydroxytryptamine receptor 1A (5-HT1A)
  • 5-hydroxytryptamine receptor 2A
  • 5-hydroxytryptamine receptor 2C
  • Adrenergic receptor alpha
  • Cytochrome P450 1A
  • Cytochrome P450 2C19
  • Cytochrome P450 2C9
  • Cytochrome P450 2D6 (2D6)
  • Cytochrome P450 3A
  • D(1A) dopamine receptor
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • Dopamine receptors; D2 & D4
  • HTR6
  • Serotonin (5-HT) receptor
  • Serotonin receptor (2b and 2c)
  • 5-chloro-N-[4-methoxy-3-(piperazin-1-yl)phenyl]-3-methyl-1-benzothiophene-2-sulfonamide hydrochloride
  • CHEMBL431298
  • SB 271046
  • SB-271046
BDBM31044
PNG
038250000
  • 5-hydroxytryptamine receptor 1A (5-HT1A)
  • Cathepsin (B and K)
  • Cathepsin L1
  • Cathepsin S
  • Dual Specificity Protein Phosphatase 1
  • Dual specificity phosphatase Cdc25B
  • HSP90 and hnRNPA2/B1
  • Heat shock factor protein 1
  • Heat shock protein HSP 90-alpha
  • Lipoamide Dehydrogenase (Lpd)
  • MKP-3
  • Nuclear receptor ROR-alpha
  • Pyruvate dehydrogenase (PDH)
  • Serotonin (5-HT) receptor
  • Sphingosine 1-phosphate receptor 1
  • Sphingosine 1-phosphate receptor 3
  • Steroidogenic Factor 1
  • diphosphomevalonate decarboxylase
  • mevalonate kinase
  • 1-Ethyl-6-methyl-3-thiophen-2-yl-1H-pyrimido[5,4-e][1,2,4]triazine-5,7-dione
  • 1-ethyl-6-methyl-3-(2-thienyl)pyrimido[5,4-e][1,2,4]triazine-5,7-quinone
  • 1-ethyl-6-methyl-3-thiophen-2-yl-pyrimido[5,4-e][1,2,4]triazine-5,7-dione
  • 1-ethyl-6-methyl-3-thiophen-2-ylpyrimido[5,4-e][1,2,4]triazine-5,7-dione
  • MLS000033110
  • SMR000008918
  • US9073941, 610
  • cid_653297
BDBM50017712
PNG
1628010000
  • 15-Lipoxygenase (LoxA)
  • 5-HT3A Serotonin Receptor
  • 5-hydroxytryptamine receptor 1A (5-HT1A)
  • ATP-binding cassette sub-family G member 2
  • Adrenaline alpha1
  • Bile salt export pump (BSEP)
  • Cystic fibrosis transmembrane conductance regulator
  • D(1A) dopamine receptor
  • D(2) dopamine receptor
  • D(3) dopamine receptor
  • DNA topoisomerase I (Topo I)
  • Multidrug resistance-associated protein 2 (MRP2)
  • P-glycoprotein 1
  • Quinolone resistance protein norA
  • Serotonin (5-HT) receptor
  • Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
  • Sodium channel protein type I I alpha subunit
  • Sodium-dependent dopamine transporter
  • Synaptic vesicular amine transporter
  • Vesicular monoamine transporter 2 (VMAT P314G)
  • Vesicular monoamine transporter 2 (VMAT P314L)
  • Vesicular monoamine transporter 2 (VMAT P314T)
  • Vesicular monoamine transporter 2 (VMAT V41A)
  • Vesicular monoamine transporter 2 (VMAT V41I)
  • Vesicular monoamine transporter 2 (VMAT2 G308A)
  • Vesicular monoamine transporter 2 (VMAT2 G308P)
  • Vesicular monoamine transporter 2 (VMAT2 V132A)
  • Vesicular monoamine transporter 2 (VMAT2 V132G)
  • Vesicular monoamine transporter 2 (VMAT2)
  • (-)-reserpine
  • (3beta,16beta,17alpha,18beta,20alpha)-11,17-dimethoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylic acid methyl ester
  • 3,4,5-trimethoxybenzoyl methyl reserpate
  • Apoplon
  • CHEMBL772
  • NCGC00091250
  • RESERPINE
  • Reserpin
  • Serpalan
  • cid_5770
  • methyl (3beta,16beta,17alpha,18beta,20alpha)-11,17-dimethoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]yohimban-16-carboxylate
BDBM50054344
PNG
045000000
  • CTD phosphatase SSU72
  • Dual specificity protein phosphatase (VHR)
  • Dual specificity protein phosphatase 23 (VHZ)
  • Dual specificity protein phosphatase CDC14A
  • Hematopoietic protein-tyrosine phosphatase (HEPTP)
  • Laforin
  • Low molecular weight phosphotyrosine protein phosphatase (LMWPTP)
  • Mitogen-activated protein kinase phosphatase 5 (MKP5)
  • Nuclear proteasome inhibitor UBLCP1
  • Protein-tyrosine phosphatase 1B
  • Protein-tyrosine phosphatase 1C
  • Protein-tyrosine phosphatase D (PTPd)
  • Protein-tyrosine phosphatase alpha
  • Protein-tyrosine phosphatase pez
  • Receptor-type tyrosine-protein phosphatase S
  • Receptor-type tyrosine-protein phosphatase epsilon (PTPε)
  • Receptor-type tyrosine-protein phosphatase gamma
  • Receptor-type tyrosine-protein phosphatase mu (PTPμ)
  • Serine/threonine-protein phosphatase 2A activator
  • Src homology-2 domain containing protein tyrosine phosphatase-2 (SHP2)
  • Tyrosine-protein phosphatase non-receptor type 11
  • Tyrosine-protein phosphatase non-receptor type 22
  • Tyrosine-protein phosphatase non-receptor type 3 (PTPH1)
  • Tyrosine-protein phosphatase non-receptor type 5 isoform a
  • tyrosine-protein phosphatase non-receptor type 5 isoform a
  • CHEMBL3319356
  • US9522881, 11a-1 L97M74
BDBM50135800
PNG
2860110000
  • Delta-type opioid receptor
  • Kappa-type opioid receptor
  • Mu-type opioid receptor
  • mu/kappa opioid receptor
  • (-)-3-Hydroxy-N-cycloproypylmethylmorphinan Mandelate
  • 17-cyclopropylmethyl-(1R,9R,10R)-17-azatetracyclo[7.5.3.01,10.02,7]heptadeca-2(7),3,5-trien-4-ol
  • 3-Hydroxy-N-cyclopropylmethylmorphinan
  • CHEMBL49269
  • CYCLORPHAN
  • US9656961, Example 00123
BDBM50169959
PNG
045000000
  • 3-phosphoinositide dependent protein kinase-1
  • CDK2/Cyclin A/Cyclin A1
  • Dual specificity mitogen-activated protein kinase kinase 1
  • Dual specificity mitogen-activated protein kinase kinase 4
  • Dual specificity mitogen-activated protein kinase kinase 6
  • Dual specificity mitogen-activated protein kinase kinase 7 (MAP2K7)
  • Dual-specificity tyrosine-phosphorylation regulated kinase 2
  • Epidermal growth factor receptor
  • Glycogen synthase kinase-3 beta
  • Inhibitor of NF-kappa-B kinase (IKK)
  • MAP kinase-activated protein kinase 2
  • MAP kinase-activated protein kinase 5
  • Mitogen-activated protein kinase 10
  • Mitogen-activated protein kinase 14
  • Mitogen-activated protein kinase 3
  • Mitogen-activated protein kinase 9
  • Protein kinase C alpha type
  • Proto-oncogene tyrosine-protein kinase Src
  • RAC-alpha serine/threonine-protein kinase AKT1
  • RAF proto-oncogene serine/threonine-protein kinase
  • Rho-associated protein kinase 2
  • Ribosomal protein S6 kinase 2/S6K1
  • Ribosomal protein S6 kinase alpha 5
  • Ribosomal protein S6 kinase alpha-3
  • Serine/threonine-protein kinase Chk1
  • Serine/threonine-protein kinase PIM
  • Serine/threonine-protein kinase Sgk1
  • Serine/threonine-protein kinase pim-3
  • Tyrosine-protein kinase Blk
  • c-Jun N-terminal kinase 3
  • c-Jun N-terminal kinase, JNK
  • 2-(benzo[d]thiazol-2(3H)-ylidene)-2-(2-(2-(pyridin-3-yl)ethylamino)pyrimidin-4-yl)acetonitrile
  • AS-601245
  • AS601245
  • CHEMBL1788116
  • CHEMBL191384
  • [3H-Benzothiazol-(2Z)-ylidene]-[2-(2-pyridin-3-yl-ethylamino)-pyrimidin-4-yl]-acetonitrile
BDBM50230993
PNG
738000000
  • Nitric Oxide Synthase, endothelial
  • Nitric Oxide Synthase, inducible
  • Nitric oxide synthase (inducible and endothelial)
  • Nitric oxide synthase, brain
  • Nitric oxide synthase, endothelial (eNOS)
  • Nitric oxide synthase, inducible
  • Nitric-oxide synthase, brain
  • (2S)-2-amino-5-[(N-methylcarbamimidoyl)amino]pentanoic acid
  • (2S)-2-ammonio-5-{[iminio(methylamino)methyl]amino}pentanoate
  • (R)-2-Amino-5-(N'-methyl-guanidino)-pentanoic acid
  • (S)-2-Amino-5-(N'-methyl-guanidino)-pentanoic acid
  • (S)-2-amino-5-(2-methylguanidino)pentanoic acid
  • (S)-2-amino-5-(3-methylguanidino)pentanoic acid
  • 2-Amino-5-(N'-methyl-guanidino)-pentanoic acid
  • CHEMBL256147
  • L-NMMA
  • N omega-methyl-L-arginine
  • N(G)-mono-methyl-L-arginine
  • N(G)-monomethyl-L-arginine
  • N-Monomethyl-L-arginine
  • N-gamma-monomethyl-L-arginine
  • NG-Monomethyl-L-Arginine
  • NG-monomethyl-L-arginine acetate
  • Ngamma-monomethyl-L-arginine
  • Targinine
BDBM50240772
PNG
831420000
  • Alpha-1A adrenergic receptor
  • Amine oxidase [flavin-containing] A
  • Amine oxidase [flavin-containing] B
  • Cytochrome P450 2A13
  • Cytochrome P450 2A6
  • Cytochrome P450 2B6
  • Cytochrome P450 2C19
  • Dopamine receptor
  • G-protein subunit alpha-16
  • Lysine-specific histone demethylase 1A
  • Lysine-specific histone demethylase 1B
  • trace amine-associated receptor 1
  • (1R,2S)-(-)-2-phenylcyclopropylamine
  • (1R,2S)-2-phenylcyclopropanamine
  • (tranylcypromine)2-Phenyl-cyclopropylamine
  • 2-Phenyl-cyclopropylamine
  • CHEMBL1179
  • Parnate
  • TRANYLCYPROMINE
  • TRANYLCYPROMINE HYDROCHLORIDE
  • US8993808, Tranylcypromine
  • US9180183, Tranylcypromine
  • cid_2723716
  • rel-Tranylcypromine
BDBM50354086
PNG
340020000
  • Histone Deacetylase 10 (HDAC10)
  • Histone deacetylase
  • Histone deacetylase 1
  • Histone deacetylase 1/3/5/8
  • Histone deacetylase 11
  • Histone deacetylase 3/NCoR1
  • Histone deacetylase 3/Nuclear receptor corepressor 2
  • Histone deacetylase 4
  • Histone deacetylase 6
  • Histone deacetylase 7 (HDAC7)
  • Histone deacetylase 8
  • Nuclear receptor corepressor 1
  • FK-228
  • Istodax
  • ROMIDEPSIN
BDBM50381716
PNG
243000000
  • ALK tyrosine kinase receptor
  • Aurora kinase A
  • Aurora kinase B
  • Cyclin-dependent kinase 9
  • Cytochrome P450 3A
  • Fibroblast growth factor receptor 1
  • Glycogen synthase kinase-3
  • Insulin-like growth factor I receptor
  • Macrophage colony-stimulating factor 1 receptor
  • Mast/stem cell growth factor receptor Kit
  • Platelet-derived growth factor receptor
  • Platelet-derived growth factor receptor beta
  • Proto-oncogene tyrosine-protein kinase receptor Ret
  • Rho-associated protein kinase 1
  • SRC
  • Tyrosine-protein kinase ABL1
  • Tyrosine-protein kinase JAK2
  • Tyrosine-protein kinase JAK3
  • Tyrosine-protein kinase Lck
  • Tyrosine-protein kinase receptor FLT3
  • Vascular endothelial growth factor receptor
  • Vascular endothelial growth factor receptor 2
  • Voltage-gated potassium channel
  • ABT-348
  • ILORASERTIB
  • US8722890, 1
  • US8722890, 2
BDBM84342
PNG
422100000
  • 5-Hydroxytryptamine receptor 7 (5-HT7)
  • ADRA1A
  • ADRA1B
  • ADRA2A
  • Alpha adrenergic receptor 1A and 1B
  • Alpha-1A adrenergic receptor
  • Alpha-2A adrenergic receptor
  • Alpha-2B adrenergic receptor
  • Alpha-2C adrenergic receptor
  • Beta-1 adrenergic receptor
  • Beta-2 adrenergic receptor and beta-3 adrenergic receptor
  • Beta-3 adrenergic receptor
  • Beta-adrenergic receptor kinase 1
  • Cerebral cortex alpha adrenergic receptor
  • DRD1
  • DRD2
  • Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor
  • Norepinephrine transporter
  • Serotonin (5-HT) receptor
  • Sodium-dependent noradrenaline transporter
  • Steroidogenic Factor 1
  • adrenergic Alpha1
  • adrenergic Alpha2
  • nuclear receptor subfamily 0 group B member 1
  • 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol
  • 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol, 1
  • 4-[1-hydroxy-2-(methylamino)ethyl]benzene-1,2-diol;hydrochloride
  • 4-[1-hydroxy-2-(methylamino)ethyl]pyrocatechol;hydrochloride
  • 4-[2-(methylamino)-1-oxidanyl-ethyl]benzene-1,2-diol;hydrochloride
  • DL-ADRENALINE HYDROCHLORIDE
  • EPINEPHRINE
  • EPINEPHRINE,(+)
  • MLS001333244
  • SMR000058236
  • cid_5924
BDBM86198
PNG
450000000
  • 5-Hydroxytryptamine receptor 6 (5-HT6)
  • 5-Hydroxytryptamine receptor 7 (5-HT7)
  • 5-hydroxytryptamine receptor 1A (5-HT1A)
  • 5-hydroxytryptamine receptor 3A
  • ADRB2
  • Adrenergic alpha1B
  • Adrenergic receptor beta
  • Alpha-1A adrenergic receptor
  • Alpha-2A adrenergic receptor
  • Alpha-2B adrenergic receptor
  • Alpha-2C adrenergic receptor
  • CHRM5
  • Calcium channel
  • Cannabinoid receptor
  • Cholinergic, Nicotinic Alpha3Beta2
  • D(1A) dopamine receptor
  • D(2) dopamine receptor
  • Dopamine D5 receptor
  • Dopamine receptor
  • Gamma-aminobutyric acid receptor subunit alpha-1 (GABA(A) alpha-1)
  • Glutamate-NMDA
  • Histamine H1 receptor
  • Histamine H2 Receptor
  • Histamine H4 receptor
  • Imidazoline I1
  • Mu-type opioid receptor
  • Muscarinic acetylcholine receptor M1
  • Muscarinic acetylcholine receptor M2
  • Muscarinic acetylcholine receptor M3
  • Muscarinic acetylcholine receptor M4
  • Neuronal acetylcholine receptor
  • Neuronal acetylcholine receptor subunit alpha-4
  • Neuronal acetylcholine receptor; alpha2/beta2
  • OPRD1
  • Serotonin (5-HT) receptor
  • Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
  • Sodium-dependent dopamine transporter
  • Sodium-dependent noradrenaline transporter
  • Sodium-dependent serotonin transporter
  • mu/kappa opioid receptor
  • CAS_134505
  • L-homocysteine thiolactone
  • NSC_134505
BDBM86205
PNG
450000000
  • 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 3A
  • ADRB2
  • Adrenergic alpha1B
  • Adrenergic receptor beta
  • Alpha-1A adrenergic receptor
  • Alpha-2A adrenergic receptor
  • Alpha-2C adrenergic receptor
  • CHRM5
  • Calcium channel
  • Cannabinoid receptor
  • Cholinergic, Nicotinic Alpha3Beta2
  • D(1A) dopamine receptor
  • D(2) dopamine receptor
  • Dopamine D5 receptor
  • Dopamine receptor
  • Gamma-aminobutyric acid receptor subunit alpha-1 (GABA(A) alpha-1)
  • Glutamate-NMDA
  • Histamine H1 receptor
  • Histamine H2 Receptor
  • Histamine H4 receptor
  • Imidazoline I1
  • Mu-type opioid receptor
  • Muscarinic acetylcholine receptor M1
  • Muscarinic acetylcholine receptor M2
  • Muscarinic acetylcholine receptor M3
  • Muscarinic acetylcholine receptor M4
  • Neuronal acetylcholine receptor
  • Neuronal acetylcholine receptor subunit alpha-4
  • Neuronal acetylcholine receptor; alpha2/beta2
  • OPRD1
  • Serotonin (5-HT) receptor
  • Serotonin receptor 2a and 2c (5HT2A and 5HT2C)
  • Sodium-dependent dopamine transporter
  • Sodium-dependent noradrenaline transporter
  • Sodium-dependent serotonin transporter
  • mu/kappa opioid receptor
  • D-homocysteine thiolactone
BDBM86701
PNG
405000000
  • D(3) dopamine receptor
  • Dopamine Transporter (DAT)
  • Muscarinic acetylcholine receptor M1
  • Muscarinic receptor M2 and M3
  • Norepinephrine Monoamine transporters
  • Sodium-dependent dopamine transporter
  • Sodium-dependent noradrenaline transporter
  • Sodium-dependent serotonin transporter
  • 3-(bis(4-fluorophenyl)methoxy)-8-methyl-8-aza-bicyclo[3.2.1]octane
  • 3-[Bis-(4-fluoro-phenyl)-methoxy]-8-methyl-8-aza-bicyclo[3.2.1]octane
  • 3-[Bis-(4-fluoro-phenyl)-methoxy]-8-methyl-8-azonia-bicyclo[3.2.1]octane
  • 4,4'-DifluoroBZT
  • CHEMBL317757
  • CHEMBL543113