Compile Data Set for Download or QSAR

Found 1697 hits Enz. Inhib. hit(s) with Target = 'Cytochrome P450 17A1'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM140970 (US8916553, 240) Show SMILES Cc1ccncc1-c1ccc(NS(C)(=O)=O)cc1C(F)(F)F Show InChI InChI=1S/C14H13F3N2O2S/c1-9-5-6-18-8-12(9)11-4-3-10(19-22(2,20)21)7-13(11)14(15,16)17/h3-8,19H,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	26	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US8916553 (2014) BindingDB Entry DOI: 10.7270/Q2XP73N9
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM140971 (US8916553, 241) Show SMILES CS(=O)(=O)Nc1ccc(-c2cncc3ccccc23)c(c1)C(F)(F)F Show InChI InChI=1S/C17H13F3N2O2S/c1-25(23,24)22-12-6-7-14(16(8-12)17(18,19)20)15-10-21-9-11-4-2-3-5-13(11)15/h2-10,22H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	48	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US8916553 (2014) BindingDB Entry DOI: 10.7270/Q2XP73N9
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM140972 (US8916553, 243) Show SMILES CS(=O)(=O)Nc1ccc(-c2cnccc2C2CC2)c(c1)C(F)(F)F Show InChI InChI=1S/C16H15F3N2O2S/c1-24(22,23)21-11-4-5-13(15(8-11)16(17,18)19)14-9-20-7-6-12(14)10-2-3-10/h4-10,21H,2-3H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	39	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US8916553 (2014) BindingDB Entry DOI: 10.7270/Q2XP73N9
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM140973 (US8916553, 245) Show SMILES COc1cc(NS(C)(=O)=O)ccc1-c1cncnc1OC Show InChI InChI=1S/C13H15N3O4S/c1-19-12-6-9(16-21(3,17)18)4-5-10(12)11-7-14-8-15-13(11)20-2/h4-8,16H,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	57	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US8916553 (2014) BindingDB Entry DOI: 10.7270/Q2XP73N9
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM140974 (US8916553, 250) Show SMILES COc1cc(NS(C)(=O)=O)ccc1-c1cncn2cccc12 Show InChI InChI=1S/C15H15N3O3S/c1-21-15-8-11(17-22(2,19)20)5-6-12(15)13-9-16-10-18-7-3-4-14(13)18/h3-10,17H,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	120	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US8916553 (2014) BindingDB Entry DOI: 10.7270/Q2XP73N9
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144614 (US8969586, 1 | US9598436, 1) Show SMILES Cc1ccncc1-c1cccc2c(noc12)-c1ccccc1 Show InChI InChI=1S/C19H14N2O/c1-13-10-11-20-12-17(13)15-8-5-9-16-18(21-22-19(15)16)14-6-3-2-4-7-14/h2-12H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.10	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144615 (US8969586, 4 | US9598436, 4) Show SMILES Cc1ncncc1-c1cccc2c(noc12)-c1ccccc1 Show InChI InChI=1S/C18H13N3O/c1-12-16(10-19-11-20-12)14-8-5-9-15-17(21-22-18(14)15)13-6-3-2-4-7-13/h2-11H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	357	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144616 (US8969586, 6 | US9598436, 6) Show SMILES Cc1ccncc1-c1cccc2c(noc12)-c1ccc(F)cc1 Show InChI InChI=1S/C19H13FN2O/c1-12-9-10-21-11-17(12)15-3-2-4-16-18(22-23-19(15)16)13-5-7-14(20)8-6-13/h2-11H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3.20	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144617 (US8969586, 14 | US9598436, 14) Show SMILES Fc1ccc(cc1)-c1noc2c(cccc12)-c1cncn2cccc12 Show InChI InChI=1S/C20H12FN3O/c21-14-8-6-13(7-9-14)19-16-4-1-3-15(20(16)25-23-19)17-11-22-12-24-10-2-5-18(17)24/h1-12H	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	192	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144618 (US8969586, 26 | US9598436, 26) Show SMILES FC(F)(F)COc1ncncc1-c1cccc2c(noc12)-c1cnccn1 Show InChI InChI=1S/C17H10F3N5O2/c18-17(19,20)8-26-16-12(6-22-9-24-16)10-2-1-3-11-14(25-27-15(10)11)13-7-21-4-5-23-13/h1-7,9H,8H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	65	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144619 (US8969586, 30 | US9598436, 30) Show SMILES Clc1ccncc1-c1cccc2c(noc12)C1CC1 Show InChI InChI=1S/C15H11ClN2O/c16-13-6-7-17-8-12(13)10-2-1-3-11-14(9-4-5-9)18-19-15(10)11/h1-3,6-9H,4-5H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	48	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144620 (US8969586, 52 | US9598436, 52) Show SMILES Clc1ccccc1-c1noc2c(cccc12)-c1cncnc1-n1cncn1 Show InChI InChI=1S/C19H11ClN6O/c20-16-7-2-1-4-13(16)17-14-6-3-5-12(18(14)27-25-17)15-8-21-9-23-19(15)26-11-22-10-24-26/h1-11H	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	42	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144621 (US8969586, 57 | US9598436, 57) Show SMILES Clc1ccccc1-c1noc2c(cccc12)-c1cncnc1-n1nccn1 Show InChI InChI=1S/C19H11ClN6O/c20-16-7-2-1-4-13(16)17-14-6-3-5-12(18(14)27-25-17)15-10-21-11-22-19(15)26-23-8-9-24-26/h1-11H	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	524	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144622 (US8969586, 68) Show SMILES COCCOc1noc2c(cccc12)-c1cnccc1C Show InChI InChI=1S/C16H16N2O3/c1-11-6-7-17-10-14(11)12-4-3-5-13-15(12)21-18-16(13)20-9-8-19-2/h3-7,10H,8-9H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	524	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144623 (US8969586, 86 | US9598436, 86) Show SMILES Cc1ccncc1-c1ccnc2c(noc12)-c1ccc(F)cc1 Show InChI InChI=1S/C18H12FN3O/c1-11-6-8-20-10-15(11)14-7-9-21-17-16(22-23-18(14)17)12-2-4-13(19)5-3-12/h2-10H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.90	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144624 (US8969586, 94 | US9598436, 94) Show SMILES Cc1ccncc1-c1ccnc2c(csc12)-c1nccs1 Show InChI InChI=1S/C16H11N3S2/c1-10-2-4-17-8-12(10)11-3-5-18-14-13(9-21-15(11)14)16-19-6-7-20-16/h2-9H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	76	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144625 (US8969586, 98 | US9598436, 98) Show SMILES Cc1ncncc1-c1ccnc2c(csc12)-c1ccc(F)cc1 Show InChI InChI=1S/C18H12FN3S/c1-11-15(8-20-10-22-11)14-6-7-21-17-16(9-23-18(14)17)12-2-4-13(19)5-3-12/h2-10H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144626 (US8969586, 99 | US9598436, 99) Show SMILES Fc1ccc(cc1)-c1csc2c(ccnc12)-c1cncnc1C1CC1 Show InChI InChI=1S/C20H14FN3S/c21-14-5-3-12(4-6-14)17-10-25-20-15(7-8-23-19(17)20)16-9-22-11-24-18(16)13-1-2-13/h3-11,13H,1-2H2	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	4	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144627 (US8969586, 103 | US9598436, 103) Show SMILES Nc1ncncc1-c1ccnc2c(csc12)-c1ccc(F)cc1Cl Show InChI InChI=1S/C17H10ClFN4S/c18-14-5-9(19)1-2-10(14)13-7-24-16-11(3-4-22-15(13)16)12-6-21-8-23-17(12)20/h1-8H,(H2,20,21,23)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144628 (US8969586, 109 | US9598436, 109) Show SMILES Fc1ccc(cc1)-c1csc2c(cccc12)-c1cncc2ccccc12 Show InChI InChI=1S/C23H14FNS/c24-17-10-8-15(9-11-17)22-14-26-23-19(6-3-7-20(22)23)21-13-25-12-16-4-1-2-5-18(16)21/h1-14H	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	56	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144629 (US8969586, 124 | US9598436, 124) Show SMILES Cc1ccncc1-c1cccc2c(OCc3ccc4ccccc4c3)noc12 Show InChI InChI=1S/C24H18N2O2/c1-16-11-12-25-14-22(16)20-7-4-8-21-23(20)28-26-24(21)27-15-17-9-10-18-5-2-3-6-19(18)13-17/h2-14H,15H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	611	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144630 (US8969586, 128 | US9598436, 128) Show SMILES Cc1ccncc1-c1cccc2c(OCc3ccc(Cl)cc3)noc12 Show InChI InChI=1S/C20H15ClN2O2/c1-13-9-10-22-11-18(13)16-3-2-4-17-19(16)25-23-20(17)24-12-14-5-7-15(21)8-6-14/h2-11H,12H2,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	251	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM144631 (US8969586, 129 | US9598436, 129) Show SMILES COc1ccc(COc2noc3c(cccc23)-c2cnccc2C)cc1 Show InChI InChI=1S/C21H18N2O3/c1-14-10-11-22-12-19(14)17-4-3-5-18-20(17)26-23-21(18)25-13-15-6-8-16(24-2)9-7-15/h3-12H,13H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	79	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US8969586 (2015) BindingDB Entry DOI: 10.7270/Q2MW2FVH
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM140930 (US8916553, 12) Show SMILES Cc1cc(NS(C)(=O)=O)ccc1-c1cnccc1-c1ccccc1 Show InChI InChI=1S/C19H18N2O2S/c1-14-12-16(21-24(2,22)23)8-9-17(14)19-13-20-11-10-18(19)15-6-4-3-5-7-15/h3-13,21H,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	104	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US8916553 (2014) BindingDB Entry DOI: 10.7270/Q2XP73N9
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM140931 (US8916553, 23) Show SMILES Cc1ccncc1-c1ccc(NS(C)(=O)=O)cc1OCC(F)F Show InChI InChI=1S/C15H16F2N2O3S/c1-10-5-6-18-8-13(10)12-4-3-11(19-23(2,20)21)7-14(12)22-9-15(16)17/h3-8,15,19H,9H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	32	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US8916553 (2014) BindingDB Entry DOI: 10.7270/Q2XP73N9
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM140932 (US8916553, 24) Show SMILES Cc1ccncc1-c1ccc(NS(C)(=O)=O)cc1OCC(F)(F)F Show InChI InChI=1S/C15H15F3N2O3S/c1-10-5-6-19-8-13(10)12-4-3-11(20-24(2,21)22)7-14(12)23-9-15(16,17)18/h3-8,20H,9H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	42	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US8916553 (2014) BindingDB Entry DOI: 10.7270/Q2XP73N9
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM140933 (US8916553, 142) Show SMILES COc1cc(NS(C)(=O)=O)ccc1-c1cncc2ccccc12 Show InChI InChI=1S/C17H16N2O3S/c1-22-17-9-13(19-23(2,20)21)7-8-15(17)16-11-18-10-12-5-3-4-6-14(12)16/h3-11,19H,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	6.60	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US8916553 (2014) BindingDB Entry DOI: 10.7270/Q2XP73N9
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM140934 (US8916553, 143) Show SMILES COc1cc(NS(=O)(=O)c2ccccc2)ccc1-c1cncc2ccccc12 Show InChI InChI=1S/C22H18N2O3S/c1-27-22-13-17(24-28(25,26)18-8-3-2-4-9-18)11-12-20(22)21-15-23-14-16-7-5-6-10-19(16)21/h2-15,24H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.90	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US8916553 (2014) BindingDB Entry DOI: 10.7270/Q2XP73N9
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM140935 (US8916553, 144) Show SMILES COc1cc(NS(=O)(=O)c2cccc3ccccc23)ccc1-c1cncc2ccccc12 Show InChI InChI=1S/C26H20N2O3S/c1-31-25-15-20(13-14-23(25)24-17-27-16-19-8-3-4-10-21(19)24)28-32(29,30)26-12-6-9-18-7-2-5-11-22(18)26/h2-17,28H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	11	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US8916553 (2014) BindingDB Entry DOI: 10.7270/Q2XP73N9
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM140936 (US8916553, 147) Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1ccc(c(OC)c1)-c1cncc2ccccc12 Show InChI InChI=1S/C23H20N2O4S/c1-28-18-8-10-19(11-9-18)30(26,27)25-17-7-12-21(23(13-17)29-2)22-15-24-14-16-5-3-4-6-20(16)22/h3-15,25H,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	2.70	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US8916553 (2014) BindingDB Entry DOI: 10.7270/Q2XP73N9
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM140937 (US8916553, 154) Show SMILES COc1cc(NS(=O)(=O)c2cccc3cccnc23)ccc1-c1cncc2ccccc12 Show InChI InChI=1S/C25H19N3O3S/c1-31-23-14-19(11-12-21(23)22-16-26-15-18-6-2-3-9-20(18)22)28-32(29,30)24-10-4-7-17-8-5-13-27-25(17)24/h2-16,28H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	27	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US8916553 (2014) BindingDB Entry DOI: 10.7270/Q2XP73N9
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM140938 (US8916553, 156) Show SMILES CCS(=O)(=O)Nc1ccc(c(OC)c1)-c1cncc2ccccc12 Show InChI InChI=1S/C18H18N2O3S/c1-3-24(21,22)20-14-8-9-16(18(10-14)23-2)17-12-19-11-13-6-4-5-7-15(13)17/h4-12,20H,3H2,1-2H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	8.10	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US8916553 (2014) BindingDB Entry DOI: 10.7270/Q2XP73N9
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM183400 (US9145419, 26) Show SMILES Fc1ccc(cc1)-c1cnc2c(ccnn12)-c1cccnc1 Show InChI InChI=1S/C17H11FN4/c18-14-5-3-12(4-6-14)16-11-20-17-15(7-9-21-22(16)17)13-2-1-8-19-10-13/h1-11H	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	524	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US9145419 (2015) BindingDB Entry DOI: 10.7270/Q208643N
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM183401 (US9145419, 34) Show SMILES Cc1ccncc1-c1ccnn2c(cnc12)-c1cc(Cl)cc(Cl)c1 Show InChI InChI=1S/C18H12Cl2N4/c1-11-2-4-21-9-16(11)15-3-5-23-24-17(10-22-18(15)24)12-6-13(19)8-14(20)7-12/h2-10H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	664	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US9145419 (2015) BindingDB Entry DOI: 10.7270/Q208643N
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM183402 (US9145419, 35) Show SMILES Cc1ccncc1-c1ccnn2c(cnc12)-c1cccs1 Show InChI InChI=1S/C16H12N4S/c1-11-4-6-17-9-13(11)12-5-7-19-20-14(10-18-16(12)20)15-3-2-8-21-15/h2-10H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US9145419 (2015) BindingDB Entry DOI: 10.7270/Q208643N
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM183403 (US9145419, 37) Show SMILES Cc1ccncc1-c1ccnn2c(cnc12)-c1cccc(c1)C(F)(F)F Show InChI InChI=1S/C19H13F3N4/c1-12-5-7-23-10-16(12)15-6-8-25-26-17(11-24-18(15)26)13-3-2-4-14(9-13)19(20,21)22/h2-11H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	129	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US9145419 (2015) BindingDB Entry DOI: 10.7270/Q208643N
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM183404 (US9145419, 38) Show SMILES Cc1cc(C)cc(c1)-c1cnc2c(ccnn12)-c1cnccc1C Show InChI InChI=1S/C20H18N4/c1-13-8-14(2)10-16(9-13)19-12-22-20-17(5-7-23-24(19)20)18-11-21-6-4-15(18)3/h4-12H,1-3H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	279	n/a	n/a	n/a	n/a	7.2	25
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 μl prepared from 7.5 μl additions of microsomes (p...				US Patent US9145419 (2015) BindingDB Entry DOI: 10.7270/Q208643N
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM208942 (US9266880, 1) Show SMILES Fc1ccc(cc1)-n1ncc2c(ccnc12)-c1cncc2ccccc12 Show InChI InChI=1S/C21H13FN4/c22-15-5-7-16(8-6-15)26-21-20(13-25-26)18(9-10-24-21)19-12-23-11-14-3-1-2-4-17(14)19/h1-13H	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	128	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US9266880 (2016) BindingDB Entry DOI: 10.7270/Q24T6H69
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM208944 (US9266880, 2) Show SMILES Fc1ccc(cc1)-n1ncc2c(ccnc12)-n1ccnc1 Show InChI InChI=1S/C15H10FN5/c16-11-1-3-12(4-2-11)21-15-13(9-19-21)14(5-6-18-15)20-8-7-17-10-20/h1-10H	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	640	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US9266880 (2016) BindingDB Entry DOI: 10.7270/Q24T6H69
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM208945 (US9266880, 3) Show SMILES Fc1ccc(cc1)-n1ncc2c(ccnc12)-c1cncc2ncccc12 Show InChI InChI=1S/C20H12FN5/c21-13-3-5-14(6-4-13)26-20-18(11-25-26)15(7-9-24-20)17-10-22-12-19-16(17)2-1-8-23-19/h1-12H	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	41	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US9266880 (2016) BindingDB Entry DOI: 10.7270/Q24T6H69
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM208947 (US9266880, 4) Show SMILES Cn1cncc1-c1ccnc2n(ncc12)-c1ccc(F)cc1 Show InChI InChI=1S/C16H12FN5/c1-21-10-18-9-15(21)13-6-7-19-16-14(13)8-20-22(16)12-4-2-11(17)3-5-12/h2-10H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	50	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US9266880 (2016) BindingDB Entry DOI: 10.7270/Q24T6H69
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM208948 (US9266880, 5) Show SMILES NS(=O)(=O)c1cccc(c1)-n1ncc2c(ccnc12)-c1cncc2ncccc12 Show InChI InChI=1S/C20H14N6O2S/c21-29(27,28)14-4-1-3-13(9-14)26-20-18(11-25-26)15(6-8-24-20)17-10-22-12-19-16(17)5-2-7-23-19/h1-12H,(H2,21,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	206	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US9266880 (2016) BindingDB Entry DOI: 10.7270/Q24T6H69
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM208951 (US9266880, 6) Show SMILES Cn1cncc1-c1ccnc2n(ncc12)-c1cccc(c1)S(N)(=O)=O Show InChI InChI=1S/C16H14N6O2S/c1-21-10-18-9-15(21)13-5-6-19-16-14(13)8-20-22(16)11-3-2-4-12(7-11)25(17,23)24/h2-10H,1H3,(H2,17,23,24)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	US Patent	n/a	n/a	271	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US9266880 (2016) BindingDB Entry DOI: 10.7270/Q24T6H69
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM208952 (US9266880, 7) Show SMILES NS(=O)(=O)c1cccc(c1)-n1ncc2c(ccnc12)-c1cncc2ccccc12 Show InChI InChI=1S/C21H15N5O2S/c22-29(27,28)16-6-3-5-15(10-16)26-21-20(13-25-26)18(8-9-24-21)19-12-23-11-14-4-1-2-7-17(14)19/h1-13H,(H2,22,27,28)	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	23	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US9266880 (2016) BindingDB Entry DOI: 10.7270/Q24T6H69
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM208953 (US9266880, 8) Show SMILES Fc1ccc(c(F)c1)-n1ncc2c(ccnc12)-c1cncn2cccc12 Show InChI InChI=1S/C19H11F2N5/c20-12-3-4-18(16(21)8-12)26-19-15(10-24-26)13(5-6-23-19)14-9-22-11-25-7-1-2-17(14)25/h1-11H	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	76	n/a	n/a	n/a	n/a	7.2	4
Bristol-Myers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US9266880 (2016) BindingDB Entry DOI: 10.7270/Q24T6H69
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM50391839 (CHEMBL2147034 | US9133160, 2) Show SMILES Cc1ccncc1-c1cccc2n(cnc12)-c1ccccn1 Show InChI InChI=1S/C18H14N4/c1-13-8-10-19-11-15(13)14-5-4-6-16-18(14)21-12-22(16)17-7-2-3-9-20-17/h2-12H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	5.80	n/a	n/a	n/a	n/a	7.2	4
Bristol-Meyers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US9133160 (2015) BindingDB Entry DOI: 10.7270/Q2KD1WQK
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM50391840 (CHEMBL2147035 | US9133160, 4) Show SMILES Cc1ccncc1-c1cccc2n(cnc12)-c1cnccn1 Show InChI InChI=1S/C17H13N5/c1-12-5-6-18-9-14(12)13-3-2-4-15-17(13)21-11-22(15)16-10-19-7-8-20-16/h2-11H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	37	n/a	n/a	n/a	n/a	7.2	4
Bristol-Meyers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US9133160 (2015) BindingDB Entry DOI: 10.7270/Q2KD1WQK
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM180269 (US9133160, 6) Show SMILES Cc1ccncc1-c1cccc2n(cnc12)-c1cccnn1 Show InChI InChI=1S/C17H13N5/c1-12-7-9-18-10-14(12)13-4-2-5-15-17(13)19-11-22(15)16-6-3-8-20-21-16/h2-11H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	250	n/a	n/a	n/a	n/a	7.2	4
Bristol-Meyers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US9133160 (2015) BindingDB Entry DOI: 10.7270/Q2KD1WQK
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM50391841 (CHEMBL2147036 | US9133160, 9) Show SMILES Cc1ccncc1-c1cccc2n(cnc12)-c1cccc(n1)C(F)(F)F Show InChI InChI=1S/C19H13F3N4/c1-12-8-9-23-10-14(12)13-4-2-5-15-18(13)24-11-26(15)17-7-3-6-16(25-17)19(20,21)22/h2-11H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	US Patent	n/a	n/a	40	n/a	n/a	n/a	n/a	7.2	4
Bristol-Meyers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US9133160 (2015) BindingDB Entry DOI: 10.7270/Q2KD1WQK
					More data for this Ligand-Target Pair
Steroid 17-alpha-hydroxylase/17,20 lyase (Homo sapiens (Human))	BDBM50391842 (CHEMBL2147037 | US9133160, 14) Show SMILES Cc1ccncc1-c1cccc2n(cnc12)-c1cccc(F)n1 Show InChI InChI=1S/C18H13FN4/c1-12-8-9-20-10-14(12)13-4-2-5-15-18(13)21-11-23(15)17-7-3-6-16(19)22-17/h2-11H,1H3	PDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	US Patent	n/a	n/a	11	n/a	n/a	n/a	n/a	7.2	4
Bristol-Meyers Squibb Company US Patent					Assay Description The assays were performed in U-bottom 384-well optiplates. The final assay volume was 15 ul prepared from 7.5 ul additions of microsomes (prepared as...				US Patent US9133160 (2015) BindingDB Entry DOI: 10.7270/Q2KD1WQK
					More data for this Ligand-Target Pair

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