Compile Data Set for Download or QSAR

Found 97 hits with Last Name = 'soderquist' and Initial = 'j'   

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
Renin (Homo sapiens (Human))	BDBM50022633 (CHEMBL3142281 | [1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CCOC(=O)N[C@@H](Cc1ccc(OC)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C33H55N3O7/c1-7-43-33(41)36-28(20-24-13-15-25(42-6)16-14-24)32(40)35-27(17-21(2)3)31(39)34-26(19-23-11-9-8-10-12-23)30(38)29(37)18-22(4)5/h13-16,21-23,26-30,37-38H,7-12,17-20H2,1-6H3,(H,34,39)(H,35,40)(H,36,41)/t26-,27?,28?,29-,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.200	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022635 (CHEMBL3142255 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CCOC(=O)N[C@@H](Cc1cccc2ccccc12)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C36H55N3O6/c1-6-45-36(44)39-31(22-27-17-12-16-26-15-10-11-18-28(26)27)35(43)38-30(19-23(2)3)34(42)37-29(21-25-13-8-7-9-14-25)33(41)32(40)20-24(4)5/h10-12,15-18,23-25,29-33,40-41H,6-9,13-14,19-22H2,1-5H3,(H,37,42)(H,38,43)(H,39,44)/t29-,30?,31?,32-,33+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.25	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022619 (CHEMBL3348544 | N-[1-(1-Cyclohexylmethyl-2,3-dihyd...) Show SMILES CC(C)CN[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C33H53N5O4/c1-22(2)15-30(39)31(40)27(16-24-11-7-5-8-12-24)37-33(42)29(18-26-20-34-21-36-26)38-32(41)28(35-19-23(3)4)17-25-13-9-6-10-14-25/h6,9-10,13-14,20-24,27-31,35,39-40H,5,7-8,11-12,15-19H2,1-4H3,(H,34,36)(H,37,42)(H,38,41)/t27?,28?,29?,30-,31+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.300	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022597 (CHEMBL3142268 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C32H53N3O6/c1-6-41-32(40)35-27(20-24-15-11-8-12-16-24)31(39)34-26(17-21(2)3)30(38)33-25(19-23-13-9-7-10-14-23)29(37)28(36)18-22(4)5/h8,11-12,15-16,21-23,25-29,36-37H,6-7,9-10,13-14,17-20H2,1-5H3,(H,33,38)(H,34,39)(H,35,40)/t25-,26?,27?,28?,29+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.300	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022599 (CHEMBL3142262 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C34H57N3O6/c1-22(2)18-27(31(40)35-26(20-24-14-10-8-11-15-24)30(39)29(38)19-23(3)4)36-32(41)28(21-25-16-12-9-13-17-25)37-33(42)43-34(5,6)7/h9,12-13,16-17,22-24,26-30,38-39H,8,10-11,14-15,18-21H2,1-7H3,(H,35,40)(H,36,41)(H,37,42)/t26?,27?,28?,29-,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.5	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022603 (CHEMBL3348551 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC Show InChI InChI=1S/C30H45N5O6/c1-3-26(36)27(37)23(15-20-11-7-5-8-12-20)33-29(39)25(17-22-18-31-19-32-22)34-28(38)24(35-30(40)41-4-2)16-21-13-9-6-10-14-21/h6,9-10,13-14,18-20,23-27,36-37H,3-5,7-8,11-12,15-17H2,1-2H3,(H,31,32)(H,33,39)(H,34,38)(H,35,40)/t23-,24?,25?,26?,27+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.5	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022628 (CHEMBL3142261 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CSC[C@@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C32H53N3O6S/c1-21(2)17-27(36)28(37)24(18-22-13-9-7-10-14-22)33-30(39)26(20-42-6)34-29(38)25(19-23-15-11-8-12-16-23)35-31(40)41-32(3,4)5/h8,11-12,15-16,21-22,24-28,36-37H,7,9-10,13-14,17-20H2,1-6H3,(H,33,39)(H,34,38)(H,35,40)/t24?,25?,26?,27-,28+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.5	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022598 (CHEMBL3348548 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CC[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C35H55N5O6/c1-23(2)16-17-30(41)31(42)27(18-24-12-8-6-9-13-24)38-33(44)29(20-26-21-36-22-37-26)39-32(43)28(19-25-14-10-7-11-15-25)40-34(45)46-35(3,4)5/h7,10-11,14-15,21-24,27-31,41-42H,6,8-9,12-13,16-20H2,1-5H3,(H,36,37)(H,38,44)(H,39,43)(H,40,45)/t27-,28?,29?,30?,31+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022595 (CHEMBL3348552 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C32H49N5O6/c1-4-43-32(42)37-26(17-23-13-9-6-10-14-23)30(40)36-27(18-24-19-33-20-34-24)31(41)35-25(16-22-11-7-5-8-12-22)29(39)28(38)15-21(2)3/h6,9-10,13-14,19-22,25-29,38-39H,4-5,7-8,11-12,15-18H2,1-3H3,(H,33,34)(H,35,41)(H,36,40)(H,37,42)/t25-,26?,27?,28?,29+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.600	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022630 (CHEMBL3348531 | Cyclohexanecarboxylic acid {1-[1-(...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)C1CCCCC1 Show InChI InChI=1S/C36H55N5O5/c1-24(2)18-32(42)33(43)29(19-25-12-6-3-7-13-25)39-36(46)31(21-28-22-37-23-38-28)41-35(45)30(20-26-14-8-4-9-15-26)40-34(44)27-16-10-5-11-17-27/h4,8-9,14-15,22-25,27,29-33,42-43H,3,5-7,10-13,16-21H2,1-2H3,(H,37,38)(H,39,46)(H,40,44)(H,41,45)/t29?,30?,31?,32-,33+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.700	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022637 (2-(2-Acetylamino-3-phenyl-propionylamino)-N-(1-cyc...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(C)=O Show InChI InChI=1S/C31H47N5O5/c1-20(2)14-28(38)29(39)25(15-22-10-6-4-7-11-22)35-31(41)27(17-24-18-32-19-33-24)36-30(40)26(34-21(3)37)16-23-12-8-5-9-13-23/h5,8-9,12-13,18-20,22,25-29,38-39H,4,6-7,10-11,14-17H2,1-3H3,(H,32,33)(H,34,37)(H,35,41)(H,36,40)/t25?,26?,27?,28-,29+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	0.75	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022593 (CHEMBL3142304 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C35H51N3O6/c1-4-44-35(43)38-30(23-27-18-12-7-13-19-27)34(42)37-29(22-26-16-10-6-11-17-26)33(41)36-28(21-25-14-8-5-9-15-25)32(40)31(39)20-24(2)3/h6-7,10-13,16-19,24-25,28-32,39-40H,4-5,8-9,14-15,20-23H2,1-3H3,(H,36,41)(H,37,42)(H,38,43)/t28-,29?,30?,31-,32+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022638 (CHEMBL3348542 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C Show InChI InChI=1S/C31H55N5O6/c1-19(2)13-24(36-30(41)42-31(5,6)7)28(39)35-25(16-22-17-32-18-33-22)29(40)34-23(15-21-11-9-8-10-12-21)27(38)26(37)14-20(3)4/h17-21,23-27,37-38H,8-16H2,1-7H3,(H,32,33)(H,34,40)(H,35,39)(H,36,41)/t23?,24?,25?,26-,27+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022607 (CHEMBL3348540 | [1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES COc1ccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc2c[nH]cn2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)[C@@H](O)CC(C)C)cc1 Show InChI InChI=1S/C35H55N5O7/c1-22(2)16-30(41)31(42)27(17-23-10-8-7-9-11-23)38-33(44)29(19-25-20-36-21-37-25)39-32(43)28(40-34(45)47-35(3,4)5)18-24-12-14-26(46-6)15-13-24/h12-15,20-23,27-31,41-42H,7-11,16-19H2,1-6H3,(H,36,37)(H,38,44)(H,39,43)(H,40,45)/t27?,28?,29?,30-,31+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022620 (CHEMBL3348532 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CC(C)COC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C34H53N5O6/c1-22(2)15-30(40)31(41)27(16-24-11-7-5-8-12-24)37-33(43)29(18-26-19-35-21-36-26)38-32(42)28(17-25-13-9-6-10-14-25)39-34(44)45-20-23(3)4/h6,9-10,13-14,19,21-24,27-31,40-41H,5,7-8,11-12,15-18,20H2,1-4H3,(H,35,36)(H,37,43)(H,38,42)(H,39,44)/t27?,28?,29?,30-,31+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022615 (CHEMBL3348546 | N-{1-[1-(1-Cyclohexylmethyl-2,3-di...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC(C)(C)C Show InChI InChI=1S/C35H55N5O5/c1-23(2)16-30(41)32(43)27(17-24-12-8-6-9-13-24)39-34(45)29(19-26-21-36-22-37-26)40-33(44)28(18-25-14-10-7-11-15-25)38-31(42)20-35(3,4)5/h7,10-11,14-15,21-24,27-30,32,41,43H,6,8-9,12-13,16-20H2,1-5H3,(H,36,37)(H,38,42)(H,39,45)(H,40,44)/t27?,28?,29?,30-,32+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022611 (CHEMBL3142260 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cn1cccn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C34H53N5O6/c1-23(2)19-29(40)30(41)26(20-24-13-8-6-9-14-24)36-32(43)28(22-39-18-12-17-35-39)37-31(42)27(21-25-15-10-7-11-16-25)38-33(44)45-34(3,4)5/h7,10-12,15-18,23-24,26-30,40-41H,6,8-9,13-14,19-22H2,1-5H3,(H,36,43)(H,37,42)(H,38,44)/t26?,27?,28?,29-,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	n/a	n/a	1	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022636 (CHEMBL3142269 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC Show InChI InChI=1S/C30H49N3O6/c1-5-26(34)27(35)23(18-21-13-9-7-10-14-21)31-28(36)24(17-20(3)4)32-29(37)25(33-30(38)39-6-2)19-22-15-11-8-12-16-22/h8,11-12,15-16,20-21,23-27,34-35H,5-7,9-10,13-14,17-19H2,1-4H3,(H,31,36)(H,32,37)(H,33,38)/t23-,24?,25?,26?,27+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022634 (CHEMBL3348541 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)OC(C)(C)C Show InChI InChI=1S/C38H55N5O6/c1-24(2)18-33(44)34(45)30(19-25-12-7-6-8-13-25)41-36(47)32(21-28-22-39-23-40-28)42-35(46)31(43-37(48)49-38(3,4)5)20-27-16-11-15-26-14-9-10-17-29(26)27/h9-11,14-17,22-25,30-34,44-45H,6-8,12-13,18-21H2,1-5H3,(H,39,40)(H,41,47)(H,42,46)(H,43,48)/t30?,31?,32?,33-,34+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.5	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022625 (CHEMBL3142263 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C37H55N3O6/c1-25(2)21-32(41)33(42)29(22-26-15-9-6-10-16-26)38-34(43)30(23-27-17-11-7-12-18-27)39-35(44)31(24-28-19-13-8-14-20-28)40-36(45)46-37(3,4)5/h7-8,11-14,17-20,25-26,29-33,41-42H,6,9-10,15-16,21-24H2,1-5H3,(H,38,43)(H,39,44)(H,40,45)/t29?,30?,31?,32-,33+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.5	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022610 (CHEMBL3348557 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CC(C)[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C33H51N5O6/c1-21(2)28(39)29(40)25(16-22-12-8-6-9-13-22)36-31(42)27(18-24-19-34-20-35-24)37-30(41)26(17-23-14-10-7-11-15-23)38-32(43)44-33(3,4)5/h7,10-11,14-15,19-22,25-29,39-40H,6,8-9,12-13,16-18H2,1-5H3,(H,34,35)(H,36,42)(H,37,41)(H,38,43)/t25-,26?,27?,28?,29+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.5	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022613 (CHEMBL430933 | {1-[1-(1-Cyclohexylmethyl-2,3-dihyd...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C34H53N5O6/c1-22(2)16-29(40)30(41)26(17-23-12-8-6-9-13-23)37-32(43)28(19-25-20-35-21-36-25)38-31(42)27(18-24-14-10-7-11-15-24)39-33(44)45-34(3,4)5/h7,10-11,14-15,20-23,26-30,40-41H,6,8-9,12-13,16-19H2,1-5H3,(H,35,36)(H,37,43)(H,38,42)(H,39,44)/t26?,27?,28?,29-,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.5	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022616 (CHEMBL3348555 | [1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CCOC(=O)N[C@@H](Cc1ccc(OC)cc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C33H51N5O7/c1-5-45-33(43)38-27(17-23-11-13-25(44-4)14-12-23)31(41)37-28(18-24-19-34-20-35-24)32(42)36-26(16-22-9-7-6-8-10-22)30(40)29(39)15-21(2)3/h11-14,19-22,26-30,39-40H,5-10,15-18H2,1-4H3,(H,34,35)(H,36,42)(H,37,41)(H,38,43)/t26-,27?,28?,29-,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.5	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022624 (CHEMBL3348549 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C32H49N5O6/c1-5-27(38)28(39)24(16-21-12-8-6-9-13-21)35-30(41)26(18-23-19-33-20-34-23)36-29(40)25(17-22-14-10-7-11-15-22)37-31(42)43-32(2,3)4/h7,10-11,14-15,19-21,24-28,38-39H,5-6,8-9,12-13,16-18H2,1-4H3,(H,33,34)(H,35,41)(H,36,40)(H,37,42)/t24-,25?,26?,27?,28+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022631 (2-(3-tert-Butyl-ureido)-N-[1-(1-cyclohexylmethyl-2...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)NC(C)(C)C Show InChI InChI=1S/C34H54N6O5/c1-22(2)16-29(41)30(42)26(17-23-12-8-6-9-13-23)37-32(44)28(19-25-20-35-21-36-25)38-31(43)27(18-24-14-10-7-11-15-24)39-33(45)40-34(3,4)5/h7,10-11,14-15,20-23,26-30,41-42H,6,8-9,12-13,16-19H2,1-5H3,(H,35,36)(H,37,44)(H,38,43)(H2,39,40,45)/t26?,27?,28?,29-,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022600 (CHEMBL3348538 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CCOC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C29H51N5O6/c1-6-40-29(39)34-23(12-18(2)3)27(37)33-24(15-21-16-30-17-31-21)28(38)32-22(14-20-10-8-7-9-11-20)26(36)25(35)13-19(4)5/h16-20,22-26,35-36H,6-15H2,1-5H3,(H,30,31)(H,32,38)(H,33,37)(H,34,39)/t22-,23?,24?,25?,26+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022629 (CHEMBL3142270 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CCOC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C29H55N3O6/c1-8-38-29(37)32-24(15-19(4)5)28(36)31-23(14-18(2)3)27(35)30-22(17-21-12-10-9-11-13-21)26(34)25(33)16-20(6)7/h18-26,33-34H,8-17H2,1-7H3,(H,30,35)(H,31,36)(H,32,37)/t22-,23?,24?,25-,26+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	PubMed	n/a	n/a	2	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022617 (CHEMBL3142274 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)OC(C)(C)C Show InChI InChI=1S/C31H59N3O6/c1-19(2)15-24(33-29(38)25(16-20(3)4)34-30(39)40-31(7,8)9)28(37)32-23(18-22-13-11-10-12-14-22)27(36)26(35)17-21(5)6/h19-27,35-36H,10-18H2,1-9H3,(H,32,37)(H,33,38)(H,34,39)/t23?,24?,25?,26-,27+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50006132 (CHEMBL297929 | [1-[1-(1-Cyclohexylmethyl-2,3-dihyd...) Show SMILES CCOC(=O)N[C@@H](Cc1ccc(I)cc1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C32H52IN3O6/c1-6-42-32(41)36-27(19-23-12-14-24(33)15-13-23)31(40)35-26(16-20(2)3)30(39)34-25(18-22-10-8-7-9-11-22)29(38)28(37)17-21(4)5/h12-15,20-22,25-29,37-38H,6-11,16-19H2,1-5H3,(H,34,39)(H,35,40)(H,36,41)/t25-,26-,27-,28-,29+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	2.5	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022883 (1N-[1-[1-cyclohexylmethyl-2-hydroxy-3-isopropylsul...) Show SMILES CC(C)SC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C33H51N5O5S/c1-22(2)44-20-29(39)26(16-23-12-8-6-9-13-23)36-31(41)28(18-25-19-34-21-35-25)37-30(40)27(17-24-14-10-7-11-15-24)38-32(42)43-33(3,4)5/h7,10-11,14-15,19,21-23,26-29,39H,6,8-9,12-13,16-18,20H2,1-5H3,(H,34,35)(H,36,41)(H,37,40)(H,38,42)/t26-,27-,28-,29-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	6.0	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human renal renin at pH 6				J Med Chem 31: 532-9 (1988) BindingDB Entry DOI: 10.7270/Q2NK3D1X
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022640 (CHEMBL3348556 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CC(C)CC[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C31H47N5O6/c1-20(37)27(38)24(15-21-11-7-5-8-12-21)34-29(40)26(17-23-18-32-19-33-23)35-28(39)25(16-22-13-9-6-10-14-22)36-30(41)42-31(2,3)4/h6,9-10,13-14,18-21,24-27,37-38H,5,7-8,11-12,15-17H2,1-4H3,(H,32,33)(H,34,40)(H,35,39)(H,36,41)/t20?,24-,25?,26?,27-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022618 (CHEMBL3142283 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C31H51N3O6/c1-20(2)17-26(35)27(36)24(18-22-13-9-7-10-14-22)33-28(37)21(3)32-29(38)25(19-23-15-11-8-12-16-23)34-30(39)40-31(4,5)6/h8,11-12,15-16,20-22,24-27,35-36H,7,9-10,13-14,17-19H2,1-6H3,(H,32,38)(H,33,37)(H,34,39)/t21?,24?,25?,26-,27+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022375 (BDBM50022873 | CHEMBL348469 | {1-[1-(1-Cyclohexylm...) Show SMILES CC(C)SC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C30H49N3O5S/c1-20(2)39-19-26(34)24(17-22-13-9-7-10-14-22)32-27(35)21(3)31-28(36)25(18-23-15-11-8-12-16-23)33-29(37)38-30(4,5)6/h8,11-12,15-16,20-22,24-26,34H,7,9-10,13-14,17-19H2,1-6H3,(H,31,36)(H,32,35)(H,33,37)/t21?,24-,25?,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	6.0	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human renal renin at pH 6				J Med Chem 31: 532-9 (1988) BindingDB Entry DOI: 10.7270/Q2NK3D1X
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022592 (CHEMBL3348547 | {1-[1-(1-Cyclohexylmethyl-2-hydrox...) Show SMILES CC(C)CC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C34H53N5O5/c1-23(2)16-17-30(40)27(18-24-12-8-6-9-13-24)37-32(42)29(20-26-21-35-22-36-26)38-31(41)28(19-25-14-10-7-11-15-25)39-33(43)44-34(3,4)5/h7,10-11,14-15,21-24,27-30,40H,6,8-9,12-13,16-20H2,1-5H3,(H,35,36)(H,37,42)(H,38,41)(H,39,43)/t27?,28?,29?,30-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022639 (CHEMBL3348539 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CCOC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC Show InChI InChI=1S/C27H47N5O6/c1-5-23(33)24(34)20(13-18-10-8-7-9-11-18)30-26(36)22(14-19-15-28-16-29-19)31-25(35)21(12-17(3)4)32-27(37)38-6-2/h15-18,20-24,33-34H,5-14H2,1-4H3,(H,28,29)(H,30,36)(H,31,35)(H,32,37)/t20-,21?,22?,23?,24+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022604 (CHEMBL3348543 | {1-[1-(2,3-Dihydroxy-1-isobutyl-5-...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C31H49N5O6/c1-19(2)13-23(27(38)26(37)14-20(3)4)34-29(40)25(16-22-17-32-18-33-22)35-28(39)24(15-21-11-9-8-10-12-21)36-30(41)42-31(5,6)7/h8-12,17-20,23-27,37-38H,13-16H2,1-7H3,(H,32,33)(H,34,40)(H,35,39)(H,36,41)/t23?,24?,25?,26-,27+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	11	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023032 (CHEMBL3144146 | {1-[1-[1-(2-Cyclohexylsulfanyl-1-h...) Show SMILES CC(C)C[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)OC(C)(C)C)[C@H](O)CSC1CCCCC1 Show InChI InChI=1S/C37H53N5O5S/c1-24(2)18-30(33(43)22-48-28-15-7-6-8-16-28)40-35(45)32(20-27-21-38-23-39-27)41-34(44)31(42-36(46)47-37(3,4)5)19-26-14-11-13-25-12-9-10-17-29(25)26/h9-14,17,21,23-24,28,30-33,43H,6-8,15-16,18-20,22H2,1-5H3,(H,38,39)(H,40,45)(H,41,44)(H,42,46)/t30-,31?,32?,33-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	13	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renal renin at the pH optimum 6.0.				J Med Chem 30: 1609-16 (1987) BindingDB Entry DOI: 10.7270/Q2W094Z9
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022884 (1N-[1-[1-benzyl-2-hydroxy-3-isopropylsulfanyl-(1S,...) Show SMILES CC(C)SC[C@H](O)[C@H](Cc1ccccc1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C33H45N5O5S/c1-22(2)44-20-29(39)26(16-23-12-8-6-9-13-23)36-31(41)28(18-25-19-34-21-35-25)37-30(40)27(17-24-14-10-7-11-15-24)38-32(42)43-33(3,4)5/h6-15,19,21-22,26-29,39H,16-18,20H2,1-5H3,(H,34,35)(H,36,41)(H,37,40)(H,38,42)/t26-,27-,28-,29-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	6.0	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human renal renin at pH 6				J Med Chem 31: 532-9 (1988) BindingDB Entry DOI: 10.7270/Q2NK3D1X
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50405545 (CHEMBL2115380 | CHEMBL3350696) Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)[C@@H](O)CSC1CCCCC1 Show InChI InChI=1S/C33H51N5O5S/c1-22(2)16-26(29(39)20-44-25-14-10-7-11-15-25)36-31(41)28(18-24-19-34-21-35-24)37-30(40)27(17-23-12-8-6-9-13-23)38-32(42)43-33(3,4)5/h6,8-9,12-13,19,21-22,25-29,39H,7,10-11,14-18,20H2,1-5H3,(H,34,35)(H,36,41)(H,37,40)(H,38,42)/t26-,27+,28+,29-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renal renin at the pH optimum 6.0.				J Med Chem 30: 1609-16 (1987) BindingDB Entry DOI: 10.7270/Q2W094Z9
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022613 (CHEMBL430933 | {1-[1-(1-Cyclohexylmethyl-2,3-dihyd...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C34H53N5O6/c1-22(2)16-29(40)30(41)26(17-23-12-8-6-9-13-23)37-32(43)28(19-25-20-35-21-36-25)38-31(42)27(18-24-14-10-7-11-15-24)39-33(44)45-34(3,4)5/h7,10-11,14-15,20-23,26-30,40-41H,6,8-9,12-13,16-19H2,1-5H3,(H,35,36)(H,37,43)(H,38,42)(H,39,44)/t26?,27?,28?,29-,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50405545 (CHEMBL2115380 | CHEMBL3350696) Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)[C@@H](O)CSC1CCCCC1 Show InChI InChI=1S/C33H51N5O5S/c1-22(2)16-26(29(39)20-44-25-14-10-7-11-15-25)36-31(41)28(18-24-19-34-21-35-24)37-30(40)27(17-23-12-8-6-9-13-23)38-32(42)43-33(3,4)5/h6,8-9,12-13,19,21-22,25-29,39H,7,10-11,14-18,20H2,1-5H3,(H,34,35)(H,36,41)(H,37,40)(H,38,42)/t26-,27+,28+,29-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renal renin at the pH optimum 6.0.				J Med Chem 30: 1609-16 (1987) BindingDB Entry DOI: 10.7270/Q2W094Z9
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023025 (CHEMBL3144145 | {1-[1-[1-(2-Cyclohexylsulfanyl-1-h...) Show SMILES CC(C)C[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccc2ccccc2c1)NC(=O)OC(C)(C)C)[C@H](O)CSC1CCCCC1 Show InChI InChI=1S/C37H53N5O5S/c1-24(2)17-30(33(43)22-48-29-13-7-6-8-14-29)40-35(45)32(20-28-21-38-23-39-28)41-34(44)31(42-36(46)47-37(3,4)5)19-25-15-16-26-11-9-10-12-27(26)18-25/h9-12,15-16,18,21,23-24,29-33,43H,6-8,13-14,17,19-20,22H2,1-5H3,(H,38,39)(H,40,45)(H,41,44)(H,42,46)/t30-,31?,32?,33-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description The compound was tested for inhibition of human renal renin at the pH optimum 7.4				J Med Chem 30: 1609-16 (1987) BindingDB Entry DOI: 10.7270/Q2W094Z9
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022606 (CHEMBL3348550 | {1-[1-(1-Cyclohexylmethyl-2,3-dihy...) Show SMILES CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1c[nH]cn1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CO Show InChI InChI=1S/C30H45N5O6/c1-30(2,3)41-29(40)35-24(15-21-12-8-5-9-13-21)27(38)34-25(16-22-17-31-19-32-22)28(39)33-23(26(37)18-36)14-20-10-6-4-7-11-20/h5,8-9,12-13,17,19-20,23-26,36-37H,4,6-7,10-11,14-16,18H2,1-3H3,(H,31,32)(H,33,39)(H,34,38)(H,35,40)/t23-,24?,25?,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	50	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50227253 (CHEMBL3348533) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](CC1C=NC=N1)NC(=O)OC(C)(C)C |c:34,36| Show InChI InChI=1S/C31H51N7O6/c1-19(2)11-26(39)27(40)23(12-20-9-7-6-8-10-20)36-28(41)24(13-21-15-32-17-34-21)37-29(42)25(14-22-16-33-18-35-22)38-30(43)44-31(3,4)5/h15-20,22-27,39-40H,6-14H2,1-5H3,(H,32,34)(H,36,41)(H,37,42)(H,38,43)/t22?,23-,24-,25-,26-,27+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem	PubMed	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50405638 (CHEMBL2114113 | CHEMBL3348524) Show SMILES CC(C)C[C@H](O)[C@@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C34H53N5O6/c1-22(2)16-29(40)30(41)26(17-23-12-8-6-9-13-23)37-32(43)28(19-25-20-35-21-36-25)38-31(42)27(18-24-14-10-7-11-15-24)39-33(44)45-34(3,4)5/h7,10-11,14-15,20-23,26-30,40-41H,6,8-9,12-13,16-19H2,1-5H3,(H,35,36)(H,37,43)(H,38,42)(H,39,44)/t26-,27-,28-,29+,30-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	70	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022608 (CHEMBL3143681 | {1-[1-(1-Formyl-3-methyl-butylcarb...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)OCc1ccccc1)C=O Show InChI InChI=1S/C33H37N5O5/c1-22(2)15-27(19-39)36-31(40)30(17-26-18-34-21-35-26)37-32(41)29(38-33(42)43-20-23-9-4-3-5-10-23)16-25-13-8-12-24-11-6-7-14-28(24)25/h3-14,18-19,21-22,27,29-30H,15-17,20H2,1-2H3,(H,34,35)(H,36,40)(H,37,41)(H,38,42)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity of the compound against renin at 10e-8(M)				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023047 (CHEMBL3144118 | {1-[1-[1-(1-Hydroxy-2-isopropylsul...) Show SMILES CC(C)C[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)[C@H](O)CSC(C)C Show InChI InChI=1S/C30H47N5O5S/c1-19(2)13-23(26(36)17-41-20(3)4)33-28(38)25(15-22-16-31-18-32-22)34-27(37)24(14-21-11-9-8-10-12-21)35-29(39)40-30(5,6)7/h8-12,16,18-20,23-26,36H,13-15,17H2,1-7H3,(H,31,32)(H,33,38)(H,34,37)(H,35,39)/t23-,24?,25?,26-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	81	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renal renin at the pH optimum 6.0.				J Med Chem 30: 1609-16 (1987) BindingDB Entry DOI: 10.7270/Q2W094Z9
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022870 (1N-[1-[1-[1-hydroxy-2-isopropylsulfanyl-(1R)-ethyl...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)[C@@H](O)CSC(C)C Show InChI InChI=1S/C30H47N5O5S/c1-19(2)13-23(26(36)17-41-20(3)4)33-28(38)25(15-22-16-31-18-32-22)34-27(37)24(14-21-11-9-8-10-12-21)35-29(39)40-30(5,6)7/h8-12,16,18-20,23-26,36H,13-15,17H2,1-7H3,(H,31,32)(H,33,38)(H,34,37)(H,35,39)/t23-,24-,25-,26-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	81	n/a	n/a	n/a	n/a	6.0	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of human renal renin at pH 6				J Med Chem 31: 532-9 (1988) BindingDB Entry DOI: 10.7270/Q2NK3D1X
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023045 (CHEMBL3144147 | {1-[1-[1-(2-Cyclohexanesulfonyl-1-...) Show SMILES CC(C)C[C@@H](NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)[C@H](O)CS(=O)(=O)C1CCCCC1 Show InChI InChI=1S/C33H51N5O7S/c1-22(2)16-26(29(39)20-46(43,44)25-14-10-7-11-15-25)36-31(41)28(18-24-19-34-21-35-24)37-30(40)27(17-23-12-8-6-9-13-23)38-32(42)45-33(3,4)5/h6,8-9,12-13,19,21-22,25-29,39H,7,10-11,14-18,20H2,1-5H3,(H,34,35)(H,36,41)(H,37,40)(H,38,42)/t26-,27?,28?,29-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renal renin at the pH optimum 6.0.				J Med Chem 30: 1609-16 (1987) BindingDB Entry DOI: 10.7270/Q2W094Z9
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50405639 (CHEMBL2115158 | CHEMBL3348523) Show SMILES CC(C)C[C@@H](O)[C@@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C34H53N5O6/c1-22(2)16-29(40)30(41)26(17-23-12-8-6-9-13-23)37-32(43)28(19-25-20-35-21-36-25)38-31(42)27(18-24-14-10-7-11-15-24)39-33(44)45-34(3,4)5/h7,10-11,14-15,20-23,26-30,40-41H,6,8-9,12-13,16-19H2,1-5H3,(H,35,36)(H,37,43)(H,38,42)(H,39,44)/t26-,27-,28-,29-,30-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	95	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description In vitro inhibitory activity was tested against purified human renal renin				J Med Chem 31: 2264-76 (1989) BindingDB Entry DOI: 10.7270/Q2T72GDD
					More data for this Ligand-Target Pair

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