Compound Names in Binding Database

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Compounds Sorted by Binding Data per Compound

1   2   3   4   5   6   7   8   9   10   11   12   13   14   15   16   17   18   19   20   21
22   23   24   25   26   27   28   29   30   31   32   33   34   35   36   37   38   39   40   41   42
43   44   45   46   47   48   49   50   51   52   53   54   55   56   57   58   59   60   61   62   63
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
106   107   109   110   111   112   113   114   118   119   120   121   122   123   124   125   126   127   128   130   131
134   136   137   138   139   140   141   146   147   148   150   152   153   154   156   157   158   159   160   161   162
163   164   165   166   168   169   171   172   173   179   185   186   188   190   194   195   199   205   207   208   212
219   221   222   223   224   225   226   233   241   243   255   261   277   285   291   293   303   305   307   324   326
330   333   335   336   337   341   357   360   366   386   389   411   442   443   444   445   446   447   448   450   453
454   456   458   459   460   461   463   465   467   469   482   496   505   511   515   516   526   529   539   555   581
773   790   804   821   824   831   837   839   847   849   853   855   868   871   880   913   922   923   931   938   960
965   989   995   997   1013   1027   1054   1096   1125   1196   1353   1429   1598

Compounds Sorted Alphabetically

Compound Name (alphabetical)	Enz. Inhib. Data							ITC Data	Binding Targets	Alternate Compound Names
Compound Name (alphabetical)	Ki	IC50	Kd	EC50	K_off	K_on	Other	ITC Data	Binding Targets	Alternate Compound Names
BDBM10017	0	9	0	0	0	0	0	0	Aromatase (CYP19) Carbonic anhydrase 2 Steryl-sulfatase	(4-{[(4-cyanophenyl)(4H-1,2,4-triazol-4-yl)amino]methyl}phenyl) sulfamate JMC503540 Compound 2 YM511 Analog 4 YM511-based dual aromatase-sulfatase inhibitor (DASI) 4 dual aromatase-sulfatase inhibitor 4
BDBM101536	5	3	0	1	0	0	0	0	PAK1 Serine/threonine-protein kinase PAK 4	CHEMBL3128043 US8530494, 203 US8530652, 114 US8530652, 63
BDBM10297	8	1	0	0	0	0	0	0	Caspase-1 Caspase-2 Caspase-3 Caspase-4 Caspase-6 Caspase-7 Caspase-8 Caspase-9	1-methyl-5-nitro-2,3-dihydro-1H-indole-2,3-dione Isatin analog 1
BDBM10298	8	1	0	0	0	0	0	0	Caspase-1 Caspase-2 Caspase-3 Caspase-4 Caspase-6 Caspase-7 Caspase-8 Caspase-9	1-benzyl-5-nitro-2,3-dihydro-1H-indole-2,3-dione Isatin analog 2
BDBM10304	6	3	0	0	0	0	0	0	Acetylcholinesterase Acyl-CoA: cholesterol acyltransferase (ACAT) Carboxylesterase 1 Caspase-3 Cholinesterase Chorismate mutase (MTB CM) Factor XIIa Human rhinovirus A protease Transthyretin	1-methyl-2,3-dihydro-1H-indole-2,3-dione CHEMBL60569 Isatin analog 8 N‐methylindol‐2,3‐dione (Compound 2)
BDBM10316	8	1	0	0	0	0	0	0	Caspase-1 Caspase-2 Caspase-3 Caspase-4 Caspase-6 Caspase-7 Caspase-8 Caspase-9	(R)-5-{1-[2-(Anilinomethyl)pyrrolidinyl]sulfonyl}isatin 5-{[(2R)-2-[(phenylamino)methyl]pyrrolidine-1-]sulfonyl}-2,3-dihydro-1H-indole-2,3-dione Isatin Sulfonamide 27
BDBM10348	1	6	0	1	0	0	0	0	Caspase-1 Caspase-3 Caspase-6 Caspase-7 Caspase-8	5-(2-(Pyridin-3-yl-oxymethyl)-pyrrolidine-1-sulfonyl)-1H-indole-2,3-dione 5-{[(2S)-2-[(pyridin-3-yloxy)methyl]pyrrolidine-1-]sulfonyl}-2,3-dihydro-1H-indole-2,3-dione IST-1 Pyridine Analogue 20
BDBM103776	6	0	0	3	0	0	0	0	Beta-2 adrenergic receptor and beta-3 adrenergic receptor Muscarinic acetylcholine receptor M3	US8551978, I-46 US8816088, I-46 US9394275, I-46 US9572802, Compound I-46 US9682957, I-46
BDBM104175	0	9	0	0	0	0	0	0	Serine/threonine-protein kinase PIM Serine/threonine-protein kinase PIM-3 Serine/threonine-protein kinase pim-2	US8575145, 157 US8575145, 158 US8575145, 52/127/128
BDBM106698	0	9	0	0	0	0	0	0	5-hydroxytryptamine 1D receptor (5HT1D) Nitric oxide synthase, brain Nitric oxide synthase, endothelial Nitric oxide synthase, inducible Nitric-oxide synthase, brain Serotonin 1B/1D receptor	CHEMBL1957349 US8586620, 42
BDBM106896	6	3	0	0	0	0	0	0	Serine/threonine-protein kinase PIM Serine/threonine-protein kinase pim-2 Serine/threonine-protein kinase pim-3	US8592455, 96
BDBM10692	0	9	0	0	0	0	0	0	Acetylcholinesterase Cholinesterase	3-{[methyl({3-[(9-oxo-9H-xanthen-3-yl)oxy]propyl})amino]methyl}phenyl N-methylcarbamate CHEMBL340427 Xanthostigmine aminoalkoxyheteroaryl deriv. 8
BDBM106950	0	9	0	0	0	0	0	0	Cyclin-Dependent Kinase 1 (CDK1) Cyclin-Dependent Kinase 2 (CDK2) Cyclin-Dependent Kinase 5 (CDK5) Cyclin-Dependent Kinase 7 (CDK7) Cyclin-Dependent Kinase 9 (CDK9) Cyclin-dependent kinase 2 Cyclin-dependent kinase 4/G1/S-specific cyclin-E1 Cyclin-dependent kinase 9	US8592581, 1
BDBM107681	0	9	0	0	0	0	0	0	HIV-1 Integrase Human immunodeficiency virus type 1 integrase	(2Z)-4-[3,5-bis(benzyloxy)phenyl]-2-hydroxy-4- oxobut-2-enoic acid (Compound 2) CHEMBL19977 CHEMBL320261
BDBM108095	9	0	0	0	0	0	0	0	Coagulation factor X Coagulation factor XI Complement C1r subcomponent Complement C1s Plasma kallikrein Plasminogen Transcription initiation factor IIA Vitamin K-dependent protein C	US8598206, Table 6, 4
BDBM108097	9	0	0	0	0	0	0	0	Coagulation factor X Coagulation factor XI Complement C1r subcomponent Complement C1s Plasma kallikrein Plasminogen Transcription initiation factor IIA Vitamin K-dependent protein C	US8598206, Table 6, 6
BDBM108101	9	0	0	0	0	0	0	0	Coagulation factor X Coagulation factor XI Complement C1r subcomponent Complement C1s Plasma kallikrein Plasminogen Transcription initiation factor IIA Vitamin K-dependent protein C	US8598206, Table 6, 10
BDBM108112	9	0	0	0	0	0	0	0	Coagulation factor X Coagulation factor XI Complement C1r subcomponent Complement C1s Plasma kallikrein Plasminogen Transcription initiation factor IIA Vitamin K-dependent protein C	US8598206, Table 6, 21
BDBM10841	0	9	0	0	0	0	0	0	Casein Kinase I Cyclin-Dependent Kinase 1 (CDK1) Cyclin-Dependent Kinase 5 (CDK5) Dual specificty protein kinase CLK1 Dual-specificity tyrosine-(Y)-phosphorylation regulated kinase 1A Glycogen Synthase Kinase-3, beta cAMP-Dependent Protein Kinase (PKA) cGMP-Dependent Protein Kinase	4-(6-bromo-1H-indol-3-yl)pyrimidin-2-amine Meridianin D
BDBM10960	0	9	0	0	0	0	0	0	Acetylcholinesterase Butyrylcholinesterase Cholinesterase	(3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyrrolo[2,3-b]indol-5-yl N-[4-(propan-2-yl)phenyl]carbamate 4-isopropylphenserine Cymserine cymserine.tartaric acid
BDBM10984	0	9	0	0	0	0	0	0	Acetylcholinesterase Cholinesterase	(3aS,8aR)-1,3a,8-trimethyl-1H,2H,3H,3aH,8H,8aH-pyrrolo[2,3-b]indol-5-yl N,N-dimethylcarbamate CHEMBL308043 N-methylphysostigmine Physostigmine analog 33
BDBM11018	9	0	0	0	0	0	0	0	Amine oxidase [flavin-containing] A Amine oxidase [flavin-containing] B Monoamine Oxidase Type B (MAO-B) Monoamine oxidase type B (MAO-B) Mutant (I199F)	2-[(E)-2-(3-chlorophenyl)ethenyl]-3,5,7-trimethyl-3H,4H,5H,6H,7H-imidazo[4,5-c]pyridine-4,6-dione 8-(3-chlorostyryl)caffeine (CSC)
BDBM11020	9	0	0	0	0	0	0	0	Amine oxidase [flavin-containing] A Amine oxidase [flavin-containing] B Monoamine Oxidase Type B (MAO-B) Monoamine oxidase type B (MAO-B) Mutant (I199F)	1,4-diphenyl-2-butene (DPB) [(2E)-4-phenylbut-2-en-1-yl]benzene
BDBM11160	0	9	0	0	0	0	0	0	Dipeptidyl peptidase 2 (DPP II) Dipeptidyl peptidase 4 Dipeptidyl peptidase 9 Dipeptidyl peptidase VIII	(3R)-3-amino-4-(2,5-difluorophenyl)-1-[3-(trifluoromethyl)-5H,6H,7H,8H-[1,2,4]triazolo[3,4-a]pyrazin-7-yl]butan-1-one hydrochloride Sitagliptin Analog 13 Triazolopiperazine Analogue 25
BDBM113577	0	9	0	0	0	0	0	0	ADAM17 Collagenase Disintegrin and metalloproteinase domain-containing protein 10 (ADAM10) Disintegrin and metalloproteinase domain-containing protein 9 (ADAM9) Matrix metalloproteinase-1 (MMP1) Stromelysin-1	US8633196, 14 US8633196, 5 US9365529, 5
BDBM11365	8	1	0	0	0	0	0	0	Aldehyde dehydrogenase 1A1 Carbonic Anhydrase IV Carbonic anhydrase 1 Carbonic anhydrase 2 Collagenase Collagenase (ChC) Matrix Metalloproteinase-8 (MMP-8) Matrix metalloproteinase-1 (MMP1)	CHEMBL98328 Hydroxysulfonamide 46 N-hydroxymethanesulfonamide
BDBM11372	8	1	0	0	0	0	0	0	Aldehyde dehydrogenase 1A1 Carbonic Anhydrase IV Carbonic anhydrase 1 Carbonic anhydrase 2 Collagenase Collagenase (ChC) Matrix Metalloproteinase-8 (MMP-8) Matrix metalloproteinase-1 (MMP1)	CHEMBL55310 Hydroxysulfonamide 53 N-hydroxybenzenesulfonamide
BDBM119122	0	9	0	0	0	0	0	0	MurA (E. coli) MurB (E. coli) MurB (S. aureus) MurC MurC (S. aureus) MurD MurD (S. aureus) MurE MurE (E. coli)	MurA/B/C/D/E inhibitor (compound 67)
BDBM120076	0	9	0	0	0	0	0	0	Cytochrome P450 1A Cytochrome P450 2C19 Cytochrome P450 2C9 Cytochrome P450 3A Macrophage colony-stimulating factor 1 receptor Macrophage colony-stimulating factor 1 receptor (c-Fms) Mast/stem cell growth factor receptor Kit Potassium voltage-gated channel subfamily H member 2	CHEMBL256712 US8697716, 16
BDBM120086	1	8	0	0	0	0	0	0	Cytochrome P450 1A Cytochrome P450 2C19 Cytochrome P450 2C9 Cytochrome P450 2D6 (2D6) Cytochrome P450 3A Mitogen-activated protein kinase 1 Potassium voltage-gated channel subfamily H member 2	US8697715, 1 US9259470, 1
BDBM120395	0	9	0	0	0	0	0	0	Mast/stem cell growth factor receptor Kit Platelet-derived growth factor receptor beta Tyrosine-protein kinase ABL1	US8703771, 13 US8703771, 14 US8703771, 8
BDBM120777	4	5	0	0	0	0	0	0	Cytochrome P450 2C9 Cytochrome P450 2D6 (2D6) Cytochrome P450 3A Orexin receptor type 1 Orexin receptor type 1 (OX1) Orexin receptor type 2	US8710076, E-2
BDBM121388	0	9	0	0	0	0	0	0	Aurora kinase A Aurora kinase B Cytochrome P450 3A Macrophage colony-stimulating factor 1 receptor Mast/stem cell growth factor receptor Kit Tyrosine-protein kinase receptor FLT3 Vascular endothelial growth factor receptor 1 Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)	US8722890, 3
BDBM121389	0	9	0	0	0	0	0	0	Aurora kinase A Aurora kinase B Cytochrome P450 3A Macrophage colony-stimulating factor 1 receptor Mast/stem cell growth factor receptor Kit Tyrosine-protein kinase receptor FLT3 Vascular endothelial growth factor receptor 1 Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)	US8722890, 4
BDBM121390	0	9	0	0	0	0	0	0	Aurora kinase A Aurora kinase B Cytochrome P450 3A Macrophage colony-stimulating factor 1 receptor Mast/stem cell growth factor receptor Kit Tyrosine-protein kinase receptor FLT3 Vascular endothelial growth factor receptor 1 Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)	US8722890, 5
BDBM123097	9	0	0	0	0	0	0	0	Cathepsin K Cathepsin L1 Cathepsin S	US8735395, 1 US9200006, 1
BDBM123098	9	0	0	0	0	0	0	0	Cathepsin K Cathepsin L1 Cathepsin S	US8735395, 2 US9200006, 2
BDBM123744	0	7	0	2	0	0	0	0	Phospholipase D (PLD) Phospholipase D (PLD_sp) Phospholipase D2 (PLD2)	5-Fluoro-N-(2-(4-(2-Oxo-2,3-dihydro-1H-benzo[d]imidazol-1-yl)piperidin-1-yl)ethyl)-1H-indole-2-carboxamide, 14 CHEMBL398567 FIPI hydrochloride hydrate (FIPI_HCl)
BDBM125378	0	9	0	0	0	0	0	0	Peptidyl-prolyl cis-trans isomerase FKBP1B/Serine/threonine-protein kinase mTOR Phosphatidylinositol 3-kinase regulatory subunit alpha Phosphatidylinositol 3-kinase regulatory subunit beta Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform/gamma isoform Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform	US9682141, 139 US9682141, 217
BDBM126693	6	3	0	0	0	0	0	0	5-hydroxytryptamine receptor 1A (5-HT1A) Cytochrome P450 2D6 (2D6) Sodium-dependent serotonin transporter	US8778970, 5-1 US8778970, 5-12 US8778970, 5-13
BDBM126937	0	9	0	0	0	0	0	0	Peptidyl-prolyl cis-trans isomerase FKBP1B/Serine/threonine-protein kinase mTOR Phosphatidylinositol 3-kinase regulatory subunit alpha Phosphatidylinositol 3-kinase regulatory subunit beta Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform/gamma isoform Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform	US9682141, 169 US9682141, 252
BDBM126938	0	9	0	0	0	0

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