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Compound Name:

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
	Ki	IC50	Kd	EC50	Koff	Kon	Other
BDBM214798	26	0	0	25	0	0	0	0	κ opioid receptor (KOR D138A) κ opioid receptor (KOR D138N) κ opioid receptor (KOR E297A) κ opioid receptor (KOR H291A) κ opioid receptor (KOR H291F) κ opioid receptor (KOR I135A) κ opioid receptor (KOR I294A) κ opioid receptor (KOR I316A) κ opioid receptor (KOR K200A) κ opioid receptor (KOR K227A) κ opioid receptor (KOR L212A) κ opioid receptor (KOR M142A) κ opioid receptor (KOR M226A) κ opioid receptor (KOR Q115A) κ opioid receptor (KOR Y119A) κ opioid receptor (KOR Y119F) κ opioid receptor (KOR Y139A) κ opioid receptor (KOR Y139F) κ opioid receptor (KOR Y312A) κ opioid receptor (KOR Y312F) κ opioid receptor (KOR Y313A) κ opioid receptor (KOR Y313F) κ opioid receptor (KOR Y320A) κ opioid receptor (KOR Y320F) κ opioid receptor (KOR Y66A) Kappa-type opioid receptor	Dynorphin A (1-17) YGGFLRRIRPKLK
BDBM214799	26	0	0	25	0	0	0	0	κ opioid receptor (KOR D138A) κ opioid receptor (KOR D138N) κ opioid receptor (KOR E297A) κ opioid receptor (KOR H291A) κ opioid receptor (KOR H291F) κ opioid receptor (KOR I135A) κ opioid receptor (KOR I294A) κ opioid receptor (KOR I316A) κ opioid receptor (KOR K200A) κ opioid receptor (KOR K227A) κ opioid receptor (KOR L212A) κ opioid receptor (KOR M142A) κ opioid receptor (KOR M226A) κ opioid receptor (KOR Q115A) κ opioid receptor (KOR Y119A) κ opioid receptor (KOR Y119F) κ opioid receptor (KOR Y139A) κ opioid receptor (KOR Y139F) κ opioid receptor (KOR Y312A) κ opioid receptor (KOR Y312F) κ opioid receptor (KOR Y313A) κ opioid receptor (KOR Y313F) κ opioid receptor (KOR Y320A) κ opioid receptor (KOR Y320F) κ opioid receptor (KOR Y66A) Kappa-type opioid receptor	1xx
BDBM50329427	0	51	0	0	0	0	0	0	ALK tyrosine kinase receptor Aurora kinase A Aurora kinase B CDK2/Cyclin A/Cyclin A1 CDK2/Cyclin E/G1/S-specific cyclin E2 Cdc7 Kinase Cell division cycle 7-related protein kinase Cyclin B/Cyclin-Dependent Kinase 1 (CDK1)/G2/mitotic-specific cyclin B2/G2/mitotic-specific cyclin B3 Cyclin-Dependent Kinase 4 (CDK4) Cyclin-Dependent Kinase 5 (CDK5) Cyclin-Dependent Kinase 9 (CDK9) Dual specificity protein kinase TTK Eukaryotic elongation factor 2 kinase Fibroblast growth factor receptor 1 Focal adhesion kinase 1 Focal adhesion kinase 1/vascular endothelial growth factor receptor 3 Glycogen synthase kinase-3 beta Hepatocyte growth factor receptor High affinity nerve growth factor receptor Inhibitor of NF-kappa-B kinase (IKK) Inhibitor of nuclear factor kappa-B kinase subunit epsilon Insulin receptor Insulin-like growth factor I receptor MAP kinase p38 beta MAP kinase-activated protein kinase 2 Mast/stem cell growth factor receptor Kit Mitogen-activated protein kinase 1 Mitogen-activated protein kinase 14 PKC alpha and beta-2 Pancreatic endoplasmic reticulum kinase (PERK) Proto-oncogene tyrosine-protein kinase receptor Ret Pyruvate dehydrogenase kinase isoenzyme 1 (PDK1) RAC-alpha serine/threonine-protein kinase AKT1 Serine/threonine-protein kinase Chk1 Serine/threonine-protein kinase MST4 Serine/threonine-protein kinase NEK6 Serine/threonine-protein kinase NIM1 Serine/threonine-protein kinase PAK 4 Serine/threonine-protein kinase PIM Serine/threonine-protein kinase PLK1 Serine/threonine-protein kinase TAO1 Tyrosine-protein kinase ABL1 Tyrosine-protein kinase BRK Tyrosine-protein kinase JAK2 Tyrosine-protein kinase JAK3 Tyrosine-protein kinase Lck Tyrosine-protein kinase SYK Tyrosine-protein kinase ZAP-70 Tyrosine-protein kinase receptor FLT3 cAMP-dependent protein kinase (PKA)	5-(2-Amino-pyrimidin-4-yl)-2-phenyl-1H-pyrrole-3-carboxamide CHEMBL1270230 US9670191, U1
BDBM50380728	8	32	0	11	0	0	0	0	Cholecystokinin receptor	CHEMBL2017835
BDBM577	28	10	1	6	0	0	0	0	Cathepsin D Cytochrome P450 3A Cytochrome P450 3A5 (CYP3A5) Gag polyprotein HIV WT-A pol protein (wild-type clade A) HIV WT-B pol protein (wild-type clade B) HIV WT-C pol protein (wild-type clade C) HIV-1 Protease HIV-1 Protease AE HIV-1 Protease AE Mutant (V82F) HIV-1 Protease AE-P HIV-1 Protease AE-P Mutant (F82V) HIV-1 Protease B Subtype HIV-1 Protease B Subtype Mutant (V82F) HIV-1 Protease Mutant (I50V) HIV-1 Protease Mutant (L10I,L19Q,K20R,E35D,M36I, ..) HIV-1 Protease Mutant (L10I/L90M) HIV-1 Protease Mutant (M46I,L63P,A71V,V82F,I84V) HIV-1 Protease Mutant (M46I/I54V) HIV-1 Protease Mutant (V82A/I84V) HIV-1 Protease Mutant M1 (L10I, G48V, I54V, L63P, V82A) HIV-1 Protease Mutant M2 (D30N, L63P, N88D) HIV-1 Protease Mutant M3 (L10I, L63P, A71V, G73S, I84V, L90M) HIV-1 Protease Mutant, MDR-HM HIV-1 Protease Mutant, MDR-QM HIV-1 isolate WT-control pol protein (CNDO control strain) HIV-1 protease Human immunodeficiency virus type 1 protease MDR1 MDRC4 P-glycoprotein 1	(3S)-oxolan-3-yl N-[(2S,3R)-4-[(4-aminobenzene)(2-methylpropyl)sulfonamido]-3-hydroxy-1-phenylbutan-2-yl]carbamate 141W94 APV Agenerase Amprenavir CHEMBL116 VX-478
BDBM8610	8	38	5	0	0	0	0	0	Aromatase (CYP19) Bile salt export pump Bile salt export pump (BSEP) Cytochrome P450 11B1, mitochondrial Cytochrome P450 11B2 (CYP11B2) Cytochrome P450 125 (CYP125) Cytochrome P450 142 (CYP142) Cytochrome P450 144 (CYP144) Cytochrome P450 17A1 Cytochrome P450 1A Cytochrome P450 24A1 Cytochrome P450 27B1 Cytochrome P450 2C19 Cytochrome P450 2C8 Cytochrome P450 2C9 Cytochrome P450 2D6 (2D6) Cytochrome P450 3A P-glycoprotein 1 Phylloquinone omega-hydroxylase CYP4F2 Sterol 14-alpha demethylase (CYP51) Uridine-5'-diphosphoglucuronosyltransferase 1A1	1-[4-(4-{[(2R,4S)-2-(2,4-dichlorophenyl)-2-(1H-imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methoxy}phenyl)piperazin-1-yl]ethan-1-one 24F2-1,25(OH)D3 CHEMBL75 KTZ Ketoconazole Ketoconazole (k) US9138393, Ketoconozole US9144538, Ketoconozole
BDBM86202	51	0	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 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 1 Cholinergic, Nicotinic Alpha3Beta2 D(1A) dopamine receptor D(2) dopamine receptor D(3) dopamine receptor Dopamine D5 receptor Dopamine receptor Gamma-aminobutyric acid receptor subunit alpha-1 (GABA(A) alpha-1) Histamine H1 receptor Histamine H2 Receptor Histamine H4 receptor Ionotropic glutamate receptor NMDA 1/2D Kappa-type opioid receptor Monoamine transporters; serotonin & dopamine 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 Oxytocin receptor Serotonin (5-HT) receptor Serotonin receptor 2a and 2c (5HT2A and 5HT2C) Sodium-dependent noradrenaline transporter Sodium-dependent serotonin transporter Vasopressin V1b receptor Vasopressin V2 receptor (V2)	CAS_778 DL-homocysteine NSC_778