Compile Data Set for Download or QSAR

Found 68 hits Enz. Inhib. hit(s) with all data for entry = 588   

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
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280297 (US10029993, Example 86) Show SMILES Cc1ccccc1-c1cnnc(n1)N1CCN(CC(=O)Nc2cccnc2)CC1 Show InChI InChI=1S/C21H23N7O/c1-16-5-2-3-7-18(16)19-14-23-26-21(25-19)28-11-9-27(10-12-28)15-20(29)24-17-6-4-8-22-13-17/h2-8,13-14H,9-12,15H2,1H3,(H,24,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.5	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280316 (US10029993, Example 183) Show SMILES Cc1ccccc1-c1cnnc(n1)N1CCC(CCCO)CC1 Show InChI InChI=1S/C18H24N4O/c1-14-5-2-3-7-16(14)17-13-19-21-18(20-17)22-10-8-15(9-11-22)6-4-12-23/h2-3,5,7,13,15,23H,4,6,8-12H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	0.700	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280305 (US10029993, Example 154) Show SMILES Cc1nc[nH]c1CN1CCC(CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C25H32ClN9O/c1-18-23(28-17-27-18)15-33-8-6-21(7-9-33)30-24(36)16-34-10-12-35(13-11-34)25-31-22(14-29-32-25)19-2-4-20(26)5-3-19/h2-5,14,17,21H,6-13,15-16H2,1H3,(H,27,28)(H,30,36)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.10	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280326 (US10029993, Example 221) Show SMILES CC(C)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C19H23F3N6O/c1-13(2)24-17(29)12-27-7-9-28(10-8-27)18-25-16(11-23-26-18)14-3-5-15(6-4-14)19(20,21)22/h3-6,11,13H,7-10,12H2,1-2H3,(H,24,29)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.40	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280321 (US10029993, Example 211) Show SMILES Cn1c(cc2ccccc12)-c1cnnc(n1)N1CCOCC1 Show InChI InChI=1S/C16H17N5O/c1-20-14-5-3-2-4-12(14)10-15(20)13-11-17-19-16(18-13)21-6-8-22-9-7-21/h2-5,10-11H,6-9H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.40	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280292 (US10029993, Example 81) Show SMILES CNC(=O)Cn1cc(NC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(Cl)cc2)cn1 Show InChI InChI=1S/C21H24ClN9O2/c1-23-19(32)14-31-12-17(10-25-31)26-20(33)13-29-6-8-30(9-7-29)21-27-18(11-24-28-21)15-2-4-16(22)5-3-15/h2-5,10-12H,6-9,13-14H2,1H3,(H,23,32)(H,26,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.70	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280324 (US10029993, Example 219) Show SMILES CC(C)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc2OCCc2c1 Show InChI InChI=1S/C20H26N6O2/c1-14(2)22-19(27)13-25-6-8-26(9-7-25)20-23-17(12-21-24-20)15-3-4-18-16(11-15)5-10-28-18/h3-4,11-12,14H,5-10,13H2,1-2H3,(H,22,27)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	3.10	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280290 (US10029993, Example 79) Show SMILES CNC(=O)Cn1cc(NC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(C)cc2)cn1 Show InChI InChI=1S/C22H27N9O2/c1-16-3-5-17(6-4-16)19-12-24-28-22(27-19)30-9-7-29(8-10-30)14-21(33)26-18-11-25-31(13-18)15-20(32)23-2/h3-6,11-13H,7-10,14-15H2,1-2H3,(H,23,32)(H,26,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.5	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280289 (US10029993, Example 76) Show SMILES CN(C)C(=O)Cn1cc(NC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(Cl)cc2)cn1 Show InChI InChI=1S/C22H26ClN9O2/c1-29(2)21(34)15-32-13-18(11-25-32)26-20(33)14-30-7-9-31(10-8-30)22-27-19(12-24-28-22)16-3-5-17(23)6-4-16/h3-6,11-13H,7-10,14-15H2,1-2H3,(H,26,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.5	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280291 (US10029993, Example 80) Show SMILES CNC(=O)Cn1cc(NC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(F)cc2)cn1 Show InChI InChI=1S/C21H24FN9O2/c1-23-19(32)14-31-12-17(10-25-31)26-20(33)13-29-6-8-30(9-7-29)21-27-18(11-24-28-21)15-2-4-16(22)5-3-15/h2-5,10-12H,6-9,13-14H2,1H3,(H,23,32)(H,26,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.5	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280277 (US10029993, Example 40) Show SMILES CN([C@H]1CC[C@@H](CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1)C(C)=O |r,wU:2.1,wD:5.8,(13.05,1.44,;13.05,-.1,;11.71,-.87,;11.71,-2.41,;10.38,-3.18,;9.05,-2.41,;9.05,-.87,;10.38,-.1,;7.71,-3.18,;6.38,-2.41,;6.38,-.87,;5.04,-3.18,;3.71,-2.41,;2.38,-3.18,;1.04,-2.41,;1.04,-.87,;2.38,-.1,;3.71,-.87,;-.29,-.1,;-.29,1.44,;-1.62,2.21,;-2.96,1.44,;-2.96,-.1,;-1.62,-.87,;-4.29,-.87,;-5.62,-.1,;-6.96,-.87,;-6.96,-2.41,;-8.29,-3.18,;-5.63,-3.18,;-4.29,-2.41,;14.38,-.87,;15.71,-.1,;14.38,-2.41,)| Show InChI InChI=1S/C24H32FN7O2/c1-17(33)30(2)21-9-7-20(8-10-21)27-23(34)16-31-11-13-32(14-12-31)24-28-22(15-26-29-24)18-3-5-19(25)6-4-18/h3-6,15,20-21H,7-14,16H2,1-2H3,(H,27,34)/t20-,21-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	4.90	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280314 (US10029993, Example 178) Show SMILES Clc1ccc(cc1)-c1cnnc(n1)N1CCN(CC1)C1CCOCC1 Show InChI InChI=1S/C18H22ClN5O/c19-15-3-1-14(2-4-15)17-13-20-22-18(21-17)24-9-7-23(8-10-24)16-5-11-25-12-6-16/h1-4,13,16H,5-12H2	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280311 (US10029993, Example 166a) Show SMILES O[C@@H]1COCC[C@@H]1NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C20H25ClN6O3/c21-15-3-1-14(2-4-15)17-11-22-25-20(24-17)27-8-6-26(7-9-27)12-19(29)23-16-5-10-30-13-18(16)28/h1-4,11,16,18,28H,5-10,12-13H2,(H,23,29)/t16-,18+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	5.60	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280317 (US10029993, Example 188) Show SMILES Cc1ccccc1-c1cnnc(n1)N1CC[C@H](C1)Oc1ccncc1 |r| Show InChI InChI=1S/C19H19N5O/c1-14-4-2-3-5-17(14)18-12-21-23-19(22-18)24-11-8-16(13-24)25-15-6-9-20-10-7-15/h2-7,9-10,12,16H,8,11,13H2,1H3/t16-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280287 (US10029993, Example 71) Show SMILES CN(C)C(=O)Cn1cc(NC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(F)cc2)cn1 Show InChI InChI=1S/C22H26FN9O2/c1-29(2)21(34)15-32-13-18(11-25-32)26-20(33)14-30-7-9-31(10-8-30)22-27-19(12-24-28-22)16-3-5-17(23)6-4-16/h3-6,11-13H,7-10,14-15H2,1-2H3,(H,26,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.10	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280315 (US10029993, Example 180) Show SMILES CC(C)NC(=O)NC1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1 Show InChI InChI=1S/C18H23FN6O/c1-12(2)21-18(26)22-15-7-9-25(10-8-15)17-23-16(11-20-24-17)13-3-5-14(19)6-4-13/h3-6,11-12,15H,7-10H2,1-2H3,(H2,21,22,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.10	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280309 (US10029993, Example 161) Show SMILES C[C@H]1COCCC1NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C21H27ClN6O2/c1-15-14-30-11-6-18(15)24-20(29)13-27-7-9-28(10-8-27)21-25-19(12-23-26-21)16-2-4-17(22)5-3-16/h2-5,12,15,18H,6-11,13-14H2,1H3,(H,24,29)/t15-,18?/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.10	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280298 (US10029993, Example 115) Show SMILES Fc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)NN2CCCC2)CC1 Show InChI InChI=1S/C19H24FN7O/c20-16-5-3-15(4-6-16)17-13-21-23-19(22-17)26-11-9-25(10-12-26)14-18(28)24-27-7-1-2-8-27/h3-6,13H,1-2,7-12,14H2,(H,24,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.30	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280281 (US10029993, Example 50) Show SMILES Cc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)N[C@H]2CC[C@@H](CC2)S(C)(=O)=O)CC1 |r,wU:24.29,wD:21.22,(-8.29,-3.18,;-6.96,-2.41,;-6.96,-.87,;-5.62,-.1,;-4.29,-.87,;-4.29,-2.41,;-5.62,-3.18,;-2.96,-.1,;-2.96,1.44,;-1.62,2.21,;-.29,1.44,;-.29,-.1,;-1.62,-.87,;1.04,-.87,;1.04,-2.41,;2.38,-3.18,;3.71,-2.41,;5.04,-3.18,;6.38,-2.41,;6.38,-.87,;7.71,-3.18,;9.04,-2.41,;10.38,-3.18,;11.71,-2.41,;11.71,-.87,;10.38,-.1,;9.04,-.87,;13.05,-.1,;14.38,-.87,;13.05,1.44,;13.05,-1.64,;3.71,-.87,;2.38,-.1,)| Show InChI InChI=1S/C23H32N6O3S/c1-17-3-5-18(6-4-17)21-15-24-27-23(26-21)29-13-11-28(12-14-29)16-22(30)25-19-7-9-20(10-8-19)33(2,31)32/h3-6,15,19-20H,7-14,16H2,1-2H3,(H,25,30)/t19-,20-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.30	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280267 (US10029993, Example 12) Show SMILES Cc1ccccc1-c1cnnc(n1)N1CCN(CC(=O)NC2CC[C@@](C)(O)CC2)CC1 |r,wU:24.26,wD:24.27,(-5.63,1.44,;-5.63,-.1,;-6.96,-.87,;-6.96,-2.41,;-5.63,-3.18,;-4.29,-2.41,;-4.29,-.87,;-2.96,-.1,;-2.96,1.44,;-1.63,2.21,;-.29,1.44,;-.29,-.1,;-1.63,-.87,;1.04,-.87,;1.04,-2.41,;2.38,-3.18,;3.71,-2.41,;5.04,-3.18,;6.38,-2.41,;6.38,-.87,;7.71,-3.18,;9.04,-2.41,;10.38,-3.18,;11.71,-2.41,;11.71,-.87,;13.05,-.1,;13.05,-1.64,;10.38,-.1,;9.04,-.87,;3.71,-.87,;2.38,-.1,)| Show InChI InChI=1S/C23H32N6O2/c1-17-5-3-4-6-19(17)20-15-24-27-22(26-20)29-13-11-28(12-14-29)16-21(30)25-18-7-9-23(2,31)10-8-18/h3-6,15,18,31H,7-14,16H2,1-2H3,(H,25,30)/t18?,23-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.90	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280282 (US10029993, Example 54) Show SMILES CN1CC[C@@H](CC1=O)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C21H26ClN7O2/c1-27-7-6-17(12-20(27)31)24-19(30)14-28-8-10-29(11-9-28)21-25-18(13-23-26-21)15-2-4-16(22)5-3-15/h2-5,13,17H,6-12,14H2,1H3,(H,24,30)/t17-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.20	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280331 (US10029993, Example 251) Show SMILES CC(C)CC(=O)NN1CCN(CC1)c1nncc(n1)-c1ccc(Cl)cc1 Show InChI InChI=1S/C18H23ClN6O/c1-13(2)11-17(26)23-25-9-7-24(8-10-25)18-21-16(12-20-22-18)14-3-5-15(19)6-4-14/h3-6,12-13H,7-11H2,1-2H3,(H,23,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.5	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280294 (US10029993, Example 83) Show SMILES CN(C)[C@H]1CC[C@@H](CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1cc(F)ccc1F |r,wU:6.9,wD:3.2,(14.67,1.93,;14.67,.39,;16,-.38,;13.34,-.38,;12,.39,;10.67,-.38,;10.67,-1.92,;12,-2.69,;13.34,-1.92,;9.34,-2.69,;8,-1.92,;8,-.38,;6.67,-2.69,;5.33,-1.92,;4,-2.69,;2.67,-1.92,;2.67,-.38,;4,.38,;5.33,-.38,;1.33,.38,;1.33,1.92,;,2.69,;-1.33,1.92,;-1.33,.38,;,-.38,;-2.67,-.38,;-2.67,-1.92,;-4,-2.69,;-4,-4.23,;-5.33,-1.92,;-5.33,-.38,;-4,.38,;-4,1.92,)| Show InChI InChI=1S/C23H31F2N7O/c1-30(2)18-6-4-17(5-7-18)27-22(33)15-31-9-11-32(12-10-31)23-28-21(14-26-29-23)19-13-16(24)3-8-20(19)25/h3,8,13-14,17-18H,4-7,9-12,15H2,1-2H3,(H,27,33)/t17-,18-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.60	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280288 (US10029993, Example 75) Show SMILES CN(C)C(=O)Cn1cc(NC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(C)cc2)cn1 Show InChI InChI=1S/C23H29N9O2/c1-17-4-6-18(7-5-17)20-13-24-28-23(27-20)31-10-8-30(9-11-31)15-21(33)26-19-12-25-32(14-19)16-22(34)29(2)3/h4-7,12-14H,8-11,15-16H2,1-3H3,(H,26,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.60	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280307 (US10029993, Example 159a) Show SMILES CN1CCO[C@@H](CNC(=O)CN2CCN(CC2)c2nncc(n2)-c2ccc(F)cc2)C1 |r| Show InChI InChI=1S/C21H28FN7O2/c1-27-10-11-31-18(14-27)12-23-20(30)15-28-6-8-29(9-7-28)21-25-19(13-24-26-21)16-2-4-17(22)5-3-16/h2-5,13,18H,6-12,14-15H2,1H3,(H,23,30)/t18-/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.70	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280269 (US10029993, Example 18) Show SMILES CN(C)[C@H]1CC[C@@H](CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(Cl)cc1 |r,wU:3.2,wD:6.9,(13.05,1.44,;13.05,-.1,;14.38,-.87,;11.71,-.87,;11.71,-2.41,;10.38,-3.18,;9.04,-2.41,;9.04,-.87,;10.38,-.1,;7.71,-3.18,;6.38,-2.41,;6.38,-.87,;5.04,-3.18,;3.71,-2.41,;2.38,-3.18,;1.04,-2.41,;1.04,-.87,;2.38,-.1,;3.71,-.87,;-.29,-.1,;-.29,1.44,;-1.62,2.21,;-2.96,1.44,;-2.96,-.1,;-1.62,-.87,;-4.29,-.87,;-5.63,-.1,;-6.96,-.87,;-6.96,-2.41,;-8.29,-3.18,;-5.63,-3.18,;-4.29,-2.41,)| Show InChI InChI=1S/C23H32ClN7O/c1-29(2)20-9-7-19(8-10-20)26-22(32)16-30-11-13-31(14-12-30)23-27-21(15-25-28-23)17-3-5-18(24)6-4-17/h3-6,15,19-20H,7-14,16H2,1-2H3,(H,26,32)/t19-,20-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	7.90	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280274 (US10029993, Example 28) Show SMILES Fc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)N[C@H]2CC[C@@H](CC2)N2CCOCC2)CC1 |r,wU:24.29,wD:21.22,(-8.29,-3.18,;-6.96,-2.41,;-6.96,-.87,;-5.62,-.1,;-4.29,-.87,;-4.29,-2.41,;-5.63,-3.18,;-2.96,-.1,;-2.96,1.44,;-1.62,2.21,;-.29,1.44,;-.29,-.1,;-1.62,-.87,;1.04,-.87,;1.04,-2.41,;2.38,-3.18,;3.71,-2.41,;5.04,-3.18,;6.38,-2.41,;6.38,-.87,;7.71,-3.18,;9.05,-2.41,;10.38,-3.18,;11.71,-2.41,;11.71,-.87,;10.38,-.1,;9.05,-.87,;13.05,-.1,;14.38,-.87,;15.71,-.1,;15.71,1.44,;14.38,2.21,;13.05,1.44,;3.71,-.87,;2.38,-.1,)| Show InChI InChI=1S/C25H34FN7O2/c26-20-3-1-19(2-4-20)23-17-27-30-25(29-23)33-11-9-31(10-12-33)18-24(34)28-21-5-7-22(8-6-21)32-13-15-35-16-14-32/h1-4,17,21-22H,5-16,18H2,(H,28,34)/t21-,22-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.40	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280272 (US10029993, Example 26) Show SMILES Fc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)N[C@H]2CC[C@@H](CC2)N2CCNC(=O)C2)CC1 |r,wU:24.29,wD:21.22,(-8.29,-3.18,;-6.96,-2.41,;-6.96,-.87,;-5.63,-.1,;-4.29,-.87,;-4.29,-2.41,;-5.63,-3.18,;-2.96,-.1,;-2.96,1.44,;-1.62,2.21,;-.29,1.44,;-.29,-.1,;-1.62,-.87,;1.04,-.87,;1.04,-2.41,;2.38,-3.18,;3.71,-2.41,;5.04,-3.18,;6.38,-2.41,;6.38,-.87,;7.71,-3.18,;9.05,-2.41,;10.38,-3.18,;11.71,-2.41,;11.71,-.87,;10.38,-.1,;9.05,-.87,;13.05,-.1,;14.38,-.87,;15.71,-.1,;15.71,1.44,;14.38,2.21,;14.38,3.75,;13.05,1.44,;3.71,-.87,;2.38,-.1,)| Show InChI InChI=1S/C25H33FN8O2/c26-19-3-1-18(2-4-19)22-15-28-31-25(30-22)33-13-11-32(12-14-33)16-24(36)29-20-5-7-21(8-6-20)34-10-9-27-23(35)17-34/h1-4,15,20-21H,5-14,16-17H2,(H,27,35)(H,29,36)/t20-,21-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.5	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280283 (US10029993, Example 55) Show SMILES CNC(=O)CO[C@H]1CC[C@@H](CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1 |r,wU:6.5,wD:9.12,(18.38,-.1,;17.05,-.87,;15.71,-.1,;15.71,1.44,;14.38,-.87,;13.05,-.1,;11.71,-.87,;11.71,-2.41,;10.38,-3.18,;9.04,-2.41,;9.04,-.87,;10.38,-.1,;7.71,-3.18,;6.38,-2.41,;6.38,-.87,;5.04,-3.18,;3.71,-2.41,;2.38,-3.18,;1.04,-2.41,;1.04,-.87,;2.38,-.1,;3.71,-.87,;-.29,-.1,;-.29,1.44,;-1.62,2.21,;-2.96,1.44,;-2.96,-.1,;-1.62,-.87,;-4.29,-.87,;-5.62,-.1,;-6.96,-.87,;-6.96,-2.41,;-8.29,-3.18,;-5.62,-3.18,;-4.29,-2.41,)| Show InChI InChI=1S/C24H32FN7O3/c1-26-23(34)16-35-20-8-6-19(7-9-20)28-22(33)15-31-10-12-32(13-11-31)24-29-21(14-27-30-24)17-2-4-18(25)5-3-17/h2-5,14,19-20H,6-13,15-16H2,1H3,(H,26,34)(H,28,33)/t19-,20-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	8.70	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280280 (US10029993, Example 48) Show SMILES CC(=O)N[C@H]1CC[C@@H](CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(C)cc1 |r,wU:4.3,wD:7.10,(15.71,-.1,;14.38,-.87,;14.38,-2.41,;13.05,-.1,;11.71,-.87,;11.71,-2.41,;10.38,-3.18,;9.04,-2.41,;9.04,-.87,;10.38,-.1,;7.71,-3.18,;6.38,-2.41,;6.38,-.87,;5.04,-3.18,;3.71,-2.41,;2.38,-3.18,;1.04,-2.41,;1.04,-.87,;2.38,-.1,;3.71,-.87,;-.29,-.1,;-.29,1.44,;-1.62,2.21,;-2.96,1.44,;-2.96,-.1,;-1.62,-.87,;-4.29,-.87,;-5.62,-.1,;-6.96,-.87,;-6.96,-2.41,;-8.29,-3.18,;-5.62,-3.18,;-4.29,-2.41,)| Show InChI InChI=1S/C24H33N7O2/c1-17-3-5-19(6-4-17)22-15-25-29-24(28-22)31-13-11-30(12-14-31)16-23(33)27-21-9-7-20(8-10-21)26-18(2)32/h3-6,15,20-21H,7-14,16H2,1-2H3,(H,26,32)(H,27,33)/t20-,21-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	US Patent	n/a	n/a	9	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280323 (US10029993, Example 218) Show SMILES CC(C)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1cccc2CCOCc12 Show InChI InChI=1S/C21H28N6O2/c1-15(2)23-20(28)13-26-7-9-27(10-8-26)21-24-19(12-22-25-21)17-5-3-4-16-6-11-29-14-18(16)17/h3-5,12,15H,6-11,13-14H2,1-2H3,(H,23,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9.80	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280296 (US10029993, Example 85) Show SMILES CNC(=O)CN1CCC(CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(C)cc1 Show InChI InChI=1S/C24H34N8O2/c1-18-3-5-19(6-4-18)21-15-26-29-24(28-21)32-13-11-31(12-14-32)17-23(34)27-20-7-9-30(10-8-20)16-22(33)25-2/h3-6,15,20H,7-14,16-17H2,1-2H3,(H,25,33)(H,27,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	9.90	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280285 (US10029993, Example 62) Show SMILES Cc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)NC2CCN(CCNS(C)(=O)=O)CC2)CC1 Show InChI InChI=1S/C24H36N8O3S/c1-19-3-5-20(6-4-19)22-17-25-29-24(28-22)32-15-13-31(14-16-32)18-23(33)27-21-7-10-30(11-8-21)12-9-26-36(2,34)35/h3-6,17,21,26H,7-16,18H2,1-2H3,(H,27,33)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	10	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280279 (US10029993, Example 47) Show SMILES Fc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)NCCN2CCS(=O)(=O)CC2)CC1 Show InChI InChI=1S/C21H28FN7O3S/c22-18-3-1-17(2-4-18)19-15-24-26-21(25-19)29-9-7-28(8-10-29)16-20(30)23-5-6-27-11-13-33(31,32)14-12-27/h1-4,15H,5-14,16H2,(H,23,30)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	11	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280301 (US10029993, Example 141) Show SMILES OC1(CC1)C(=O)N1CC(C1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1 Show InChI InChI=1S/C22H26FN7O3/c23-16-3-1-15(2-4-16)18-11-24-27-21(26-18)29-9-7-28(8-10-29)14-19(31)25-17-12-30(13-17)20(32)22(33)5-6-22/h1-4,11,17,33H,5-10,12-14H2,(H,25,31)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	11	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280330 (US10029993, Example 244) Show SMILES Cc1ccccc1-c1cnnc(n1)C1CCCN(C1)c1cnccn1 Show InChI InChI=1S/C19H20N6/c1-14-5-2-3-7-16(14)17-11-22-24-19(23-17)15-6-4-10-25(13-15)18-12-20-8-9-21-18/h2-3,5,7-9,11-12,15H,4,6,10,13H2,1H3	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	11	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280312 (US10029993, Example 167a) Show SMILES CC(=O)N[C@@H]1CCC[C@@H](C1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(Cl)cc1 |r| Show InChI InChI=1S/C23H30ClN7O2/c1-16(32)26-19-3-2-4-20(13-19)27-22(33)15-30-9-11-31(12-10-30)23-28-21(14-25-29-23)17-5-7-18(24)8-6-17/h5-8,14,19-20H,2-4,9-13,15H2,1H3,(H,26,32)(H,27,33)/t19-,20+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	11	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280293 (US10029993, Example 82) Show SMILES CN1CCNC(=O)[C@@]11CCC(CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1 |r,wU:7.7,(12,1.93,;13.34,1.16,;14.67,1.93,;16,1.16,;16,-.38,;14.67,-1.15,;14.67,-2.69,;13.34,-.38,;13.34,-1.92,;12,-2.69,;10.67,-1.92,;10.67,-.38,;12,.39,;9.34,-2.69,;8,-1.92,;8,-.38,;6.67,-2.69,;5.33,-1.92,;4,-2.69,;2.67,-1.92,;2.67,-.38,;4,.38,;5.33,-.38,;1.33,.38,;1.33,1.92,;,2.69,;-1.33,1.92,;-1.33,.38,;,-.38,;-2.67,-.38,;-4,.38,;-5.33,-.38,;-5.33,-1.92,;-6.67,-2.69,;-4,-2.69,;-2.67,-1.92,)| Show InChI InChI=1S/C25H33FN8O2/c1-32-11-10-27-23(36)25(32)8-6-20(7-9-25)29-22(35)17-33-12-14-34(15-13-33)24-30-21(16-28-31-24)18-2-4-19(26)5-3-18/h2-5,16,20H,6-15,17H2,1H3,(H,27,36)(H,29,35)/t20?,25-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	12	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280320 (US10029993, Example 199) Show SMILES O=C1NCC2(CCN(CC2)c2nncc(n2)-c2ccc3ccccc3c2)O1 Show InChI InChI=1S/C20H19N5O2/c26-19-21-13-20(27-19)7-9-25(10-8-20)18-23-17(12-22-24-18)16-6-5-14-3-1-2-4-15(14)11-16/h1-6,11-12H,7-10,13H2,(H,21,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	12	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280300 (US10029993, Example 135) Show SMILES CC[C@@H](O)C(=O)N1CCC(CC1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C24H32FN7O3/c1-2-21(33)23(35)31-9-7-19(8-10-31)27-22(34)16-30-11-13-32(14-12-30)24-28-20(15-26-29-24)17-3-5-18(25)6-4-17/h3-6,15,19,21,33H,2,7-14,16H2,1H3,(H,27,34)/t21-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	12	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280273 (US10029993, Example 27) Show SMILES Clc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)NC2CCS(=O)(=O)CC2)CC1 Show InChI InChI=1S/C20H25ClN6O3S/c21-16-3-1-15(2-4-16)18-13-22-25-20(24-18)27-9-7-26(8-10-27)14-19(28)23-17-5-11-31(29,30)12-6-17/h1-4,13,17H,5-12,14H2,(H,23,28)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	13	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280334 (US10029993, Example 257) Show SMILES Clc1ccc(CNc2cnnc(n2)N2CCOCC2)cc1 Show InChI InChI=1S/C14H16ClN5O/c15-12-3-1-11(2-4-12)9-16-13-10-17-19-14(18-13)20-5-7-21-8-6-20/h1-4,10H,5-9H2,(H,16,18,19)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	13	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280308 (US10029993, Example 160) Show SMILES CN(C)[C@@H]1CCC[C@@H](C1)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1 |r| Show InChI InChI=1S/C23H32FN7O/c1-29(2)20-5-3-4-19(14-20)26-22(32)16-30-10-12-31(13-11-30)23-27-21(15-25-28-23)17-6-8-18(24)9-7-17/h6-9,15,19-20H,3-5,10-14,16H2,1-2H3,(H,26,32)/t19-,20+/m0/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	13	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280306 (US10029993, Example 157a) Show SMILES OC1C2COCC1CC(C2)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(cc1)C(F)(F)F |TLB:0:1:8.7.9:4.3.5,10:8:1:4.3.5,(11.24,-7.1,;9.75,-7.5,;8.96,-6.18,;8.96,-4.64,;7.47,-4.24,;8.26,-5.56,;8.26,-7.1,;6.77,-7.5,;6,-6.16,;7.49,-6.55,;4.67,-6.93,;3.34,-6.16,;3.34,-4.62,;2,-6.93,;.67,-6.16,;-.66,-6.93,;-2,-6.16,;-2,-4.62,;-.66,-3.85,;.67,-4.62,;-3.33,-3.85,;-3.33,-2.31,;-4.66,-1.54,;-6,-2.31,;-6,-3.85,;-4.66,-4.62,;-7.33,-4.62,;-7.33,-6.16,;-8.67,-6.93,;-10,-6.16,;-10,-4.62,;-8.67,-3.85,;-11.33,-6.93,;-12.67,-6.16,;-11.33,-8.47,;-12.67,-7.7,)| Show InChI InChI=1S/C24H29F3N6O3/c25-24(26,27)18-3-1-15(2-4-18)20-11-28-31-23(30-20)33-7-5-32(6-8-33)12-21(34)29-19-9-16-13-36-14-17(10-19)22(16)35/h1-4,11,16-17,19,22,35H,5-10,12-14H2,(H,29,34)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	14	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280276 (US10029993, Example 38) Show SMILES Fc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)NC2CCN(CC(=O)N3CCOCC3)CC2)CC1 Show InChI InChI=1S/C26H35FN8O3/c27-21-3-1-20(2-4-21)23-17-28-31-26(30-23)35-11-9-33(10-12-35)18-24(36)29-22-5-7-32(8-6-22)19-25(37)34-13-15-38-16-14-34/h1-4,17,22H,5-16,18-19H2,(H,29,36)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	14	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280332 (US10029993, Example 252) Show SMILES CN(C)[C@H]1CC[C@@H](CC1)NC(=O)C(O)C1CCN(CC1)c1nncc(n1)-c1ccc(F)cc1 |r,wU:3.2,wD:6.9,(10.03,-3.02,;10.03,-4.56,;11.36,-5.33,;8.69,-5.33,;8.69,-6.87,;7.36,-7.64,;6.03,-6.87,;6.03,-5.33,;7.36,-4.56,;4.69,-7.64,;3.36,-6.87,;3.36,-5.33,;2.02,-7.64,;2.02,-9.18,;.69,-6.87,;-.64,-7.64,;-1.98,-6.87,;-1.98,-5.33,;-.64,-4.56,;.69,-5.33,;-3.31,-4.56,;-3.31,-3.02,;-4.64,-2.25,;-5.98,-3.02,;-5.98,-4.56,;-4.64,-5.33,;-7.31,-5.33,;-8.64,-4.56,;-9.98,-5.33,;-9.98,-6.87,;-11.31,-7.64,;-8.64,-7.64,;-7.31,-6.87,)| Show InChI InChI=1S/C24H33FN6O2/c1-30(2)20-9-7-19(8-10-20)27-23(33)22(32)17-11-13-31(14-12-17)24-28-21(15-26-29-24)16-3-5-18(25)6-4-16/h3-6,15,17,19-20,22,32H,7-14H2,1-2H3,(H,27,33)/t19-,20-,22?	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	15	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280310 (US10029993, Example 164a) Show SMILES O[C@H]1COC[C@H]1NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(cc1)C(F)(F)F |r| Show InChI InChI=1S/C20H23F3N6O3/c21-20(22,23)14-3-1-13(2-4-14)15-9-24-27-19(26-15)29-7-5-28(6-8-29)10-18(31)25-16-11-32-12-17(16)30/h1-4,9,16-17,30H,5-8,10-12H2,(H,25,31)/t16-,17+/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	16	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280303 (US10029993, Example 151) Show SMILES Fc1ccc(cc1)-c1cnnc(n1)N1CCN(CC(=O)NC2CCN(CC3=NCCN3)CC2)CC1 |t:28| Show InChI InChI=1S/C24H32FN9O/c25-19-3-1-18(2-4-19)21-15-28-31-24(30-21)34-13-11-33(12-14-34)17-23(35)29-20-5-9-32(10-6-20)16-22-26-7-8-27-22/h1-4,15,20H,5-14,16-17H2,(H,26,27)(H,29,35)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	16	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280299 (US10029993, Example 124) Show SMILES C[C@H]1CC[C@@H](CC1)c1cnnc(n1)N1CCN(CC(=O)N[C@H]2CC[C@@H](CC2)N(C)C)CC1 |r,wU:4.7,24.29,wD:1.0,21.22,(-2.58,-27.86,;-1.06,-27.09,;.27,-27.86,;1.6,-27.09,;1.6,-25.55,;.27,-24.78,;-1.06,-25.55,;3.12,-24.78,;3.12,-23.24,;4.45,-22.47,;5.78,-23.24,;5.78,-24.78,;4.45,-25.55,;7.3,-25.55,;7.3,-27.09,;8.63,-27.86,;9.97,-27.09,;11.3,-27.86,;12.63,-27.09,;12.63,-25.55,;13.97,-27.86,;15.3,-27.09,;16.63,-27.86,;17.97,-27.09,;17.97,-25.55,;16.63,-24.78,;15.3,-25.55,;19.3,-24.78,;19.3,-23.24,;20.63,-25.55,;9.97,-25.55,;8.63,-24.78,)| Show InChI InChI=1S/C24H41N7O/c1-18-4-6-19(7-5-18)22-16-25-28-24(27-22)31-14-12-30(13-15-31)17-23(32)26-20-8-10-21(11-9-20)29(2)3/h16,18-21H,4-15,17H2,1-3H3,(H,26,32)/t18-,19-,20-,21-	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	16	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair
Cytochrome P450 11B2, mitochondrial (Homo sapiens (Human))	BDBM280268 (US10029993, Example 16) Show SMILES CC(C)[C@@H](CO)NC(=O)CN1CCN(CC1)c1nncc(n1)-c1ccc(cc1)C(F)(F)F |r| Show InChI InChI=1S/C21H27F3N6O2/c1-14(2)18(13-31)26-19(32)12-29-7-9-30(10-8-29)20-27-17(11-25-28-20)15-3-5-16(6-4-15)21(22,23)24/h3-6,11,14,18,31H,7-10,12-13H2,1-2H3,(H,26,32)/t18-/m1/s1	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	16	n/a	n/a	n/a	n/a	7.4	25
MITSUBISHI TANABE PHARMA CORPORATION US Patent					Assay Description The pcDNA3.1-human CYP11B2 plasmid was transfected into a Chinese hamster lung fibroblast V79 cell line to produce a cell line stably expressing huma...				US Patent US10029993 (2018) BindingDB Entry DOI: 10.7270/Q2V40X6M
					More data for this Ligand-Target Pair

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