Compile Data Set for Download or QSAR

Found 144 hits with Last Name = 'perun' and Initial = 'tj'   

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))	BDBM50405479 (CHEMBL2028988) Show SMILES CC[C@H](C)[C@H](NC(=O)[C@@H](NC(O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](Cc1cnc[nH]1)NC(=O)OC(C)(C)C)C(C)C)C(=O)N[C@@H](Cc1cnc[nH]1)C(O)=O |r| Show InChI InChI=1S/C54H80N14O11/c1-10-32(6)44(50(74)64-41(52(76)77)23-36-26-57-29-60-36)67-49(73)43(31(4)5)66-47(71)37(19-30(2)3)61-46(70)39(21-34-24-55-27-58-34)62-45(69)38(20-33-15-12-11-13-16-33)63-48(72)42-17-14-18-68(42)51(75)40(22-35-25-56-28-59-35)65-53(78)79-54(7,8)9/h11-13,15-16,24-32,37-44,47,66,71H,10,14,17-23H2,1-9H3,(H,55,58)(H,56,59)(H,57,60)(H,61,70)(H,62,69)(H,63,72)(H,64,74)(H,65,78)(H,67,73)(H,76,77)/t32-,37-,38-,39-,40-,41-,42-,43-,44-,47?/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	0.700	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against human plasma renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					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))	BDBM50022960 (CHEMBL3143448 | [1-[1-[1-Cyclohexylmethyl-2-hydrox...) 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)CCNC(=O)CCC(C)C)cc1 Show InChI InChI=1S/C38H60N6O7/c1-25(2)12-17-34(46)40-19-18-33(45)30(20-26-10-8-7-9-11-26)42-36(48)32(22-28-23-39-24-41-28)43-35(47)31(44-37(49)51-38(3,4)5)21-27-13-15-29(50-6)16-14-27/h13-16,23-26,30-33,45H,7-12,17-22H2,1-6H3,(H,39,41)(H,40,46)(H,42,48)(H,43,47)(H,44,49)/t30-,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	4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 30: 1224-8 (1987) BindingDB Entry DOI: 10.7270/Q2X63NJ7
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022954 (CHEMBL3143452 | {1-[1-[1-Cyclohexylmethyl-2-hydrox...) Show SMILES CC(C)CCNC(=O)C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C |r| Show InChI InChI=1S/C36H56N6O6/c1-24(2)16-17-38-32(44)21-31(43)28(18-25-12-8-6-9-13-25)40-34(46)30(20-27-22-37-23-39-27)41-33(45)29(19-26-14-10-7-11-15-26)42-35(47)48-36(3,4)5/h7,10-11,14-15,22-25,28-31,43H,6,8-9,12-13,16-21H2,1-5H3,(H,37,39)(H,38,44)(H,40,46)(H,41,45)(H,42,47)	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	5	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 30: 1224-8 (1987) BindingDB Entry DOI: 10.7270/Q2X63NJ7
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023064 (CHEMBL297628 | N-{1-[1-[1-Cyclohexylmethyl-2-hydro...) Show SMILES CC(C)S(=O)(=O)CC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC(C)(C)C Show InChI InChI=1S/C35H55N5O6S/c1-24(2)47(45,46)17-16-31(41)28(18-25-12-8-6-9-13-25)39-34(44)30(20-27-22-36-23-37-27)40-33(43)29(19-26-14-10-7-11-15-26)38-32(42)21-35(3,4)5/h7,10-11,14-15,22-25,28-31,41H,6,8-9,12-13,16-21H2,1-5H3,(H,36,37)(H,38,42)(H,39,44)(H,40,43)/t28-,29-,30-,31-/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	6	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against human plasma renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022958 ((1-{1-[1-Cyclohexylmethyl-2-hydroxy-4-(4-methyl-pe...) Show SMILES CC(C)CCC(=O)NCC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnccn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C38H58N6O6/c1-26(2)16-17-34(46)41-19-18-33(45)30(22-27-12-8-6-9-13-27)42-36(48)32(24-29-25-39-20-21-40-29)43-35(47)31(23-28-14-10-7-11-15-28)44-37(49)50-38(3,4)5/h7,10-11,14-15,20-21,25-27,30-33,45H,6,8-9,12-13,16-19,22-24H2,1-5H3,(H,41,46)(H,42,48)(H,43,47)(H,44,49)/t30-,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	6	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 30: 1224-8 (1987) BindingDB Entry DOI: 10.7270/Q2X63NJ7
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023070 (CHEMBL300724 | {1-[1-(1-Cyclohexylmethyl-4-ethanes...) Show SMILES CCS(=O)(=O)CC[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/C33H51N5O7S/c1-5-46(43,44)17-16-29(39)26(18-23-12-8-6-9-13-23)36-31(41)28(20-25-21-34-22-35-25)37-30(40)27(19-24-14-10-7-11-15-24)38-32(42)45-33(2,3)4/h7,10-11,14-15,21-23,26-29,39H,5-6,8-9,12-13,16-20H2,1-4H3,(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	7.60	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against purified human renal renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023062 (((S)-1-{(S)-1-[1-Cyclohexylmethyl-2-hydroxy-4-((S)...) Show SMILES CC(C)S(=O)(=O)CC[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/C34H53N5O7S/c1-23(2)47(44,45)17-16-30(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)46-34(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 PC cid PC sid UniChem Similars	PubMed	n/a	n/a	7.60	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against purified human renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					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))	BDBM50023059 (CHEMBL45727 | [1-[1-[1-Cyclohexylmethyl-2-hydroxy-...) Show SMILES COc1ccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)CCS(=O)(=O)C(C)C)cc1 Show InChI InChI=1S/C35H55N5O8S/c1-23(2)49(45,46)17-16-31(41)28(18-24-10-8-7-9-11-24)38-33(43)30(20-26-21-36-22-37-26)39-32(42)29(40-34(44)48-35(3,4)5)19-25-12-14-27(47-6)15-13-25/h12-15,21-24,28-31,41H,7-11,16-20H2,1-6H3,(H,36,37)(H,38,43)(H,39,42)(H,40,44)/t28-,29-,30-,31-/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	9.10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against purified human renal renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022961 ((1-{1-[1-Cyclohexylmethyl-2-hydroxy-4-(4-methyl-pe...) Show SMILES CC(C)CCC(=O)NCC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cscn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C37H57N5O6S/c1-25(2)16-17-33(44)38-19-18-32(43)29(20-26-12-8-6-9-13-26)40-35(46)31(22-28-23-49-24-39-28)41-34(45)30(21-27-14-10-7-11-15-27)42-36(47)48-37(3,4)5/h7,10-11,14-15,23-26,29-32,43H,6,8-9,12-13,16-22H2,1-5H3,(H,38,44)(H,40,46)(H,41,45)(H,42,47)/t29-,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	10	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 30: 1224-8 (1987) BindingDB Entry DOI: 10.7270/Q2X63NJ7
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023057 (CHEMBL300036 | {1-[1-[1-Cyclohexylmethyl-2-hydroxy...) Show SMILES CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCS(=O)(=O)C(C)C Show InChI InChI=1S/C32H49N5O7S/c1-4-44-32(41)37-27(18-24-13-9-6-10-14-24)30(39)36-28(19-25-20-33-21-34-25)31(40)35-26(17-23-11-7-5-8-12-23)29(38)15-16-45(42,43)22(2)3/h6,9-10,13-14,20-23,26-29,38H,4-5,7-8,11-12,15-19H2,1-3H3,(H,33,34)(H,35,40)(H,36,39)(H,37,41)/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	10	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against purified human renal renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					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))	BDBM50023058 ((1-{1-[1-Cyclohexylmethyl-2-hydroxy-4-(propane-2-s...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCS(=O)(=O)C(C)C Show InChI InChI=1S/C34H57N3O7S/c1-23(2)20-28(36-32(40)29(22-26-16-12-9-13-17-26)37-33(41)44-34(5,6)7)31(39)35-27(21-25-14-10-8-11-15-25)30(38)18-19-45(42,43)24(3)4/h9,12-13,16-17,23-25,27-30,38H,8,10-11,14-15,18-22H2,1-7H3,(H,35,39)(H,36,40)(H,37,41)/t27-,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	14	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against purified human renal renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022956 (CHEMBL3143451 | {1-[1-[1-Cyclohexylmethyl-2-hydrox...) Show SMILES CC(C)CCC(=O)NCC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cn(C)cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C38H60N6O6/c1-26(2)17-18-34(46)39-20-19-33(45)30(21-27-13-9-7-10-14-27)41-36(48)32(23-29-24-44(6)25-40-29)42-35(47)31(22-28-15-11-8-12-16-28)43-37(49)50-38(3,4)5/h8,11-12,15-16,24-27,30-33,45H,7,9-10,13-14,17-23H2,1-6H3,(H,39,46)(H,41,48)(H,42,47)(H,43,49)/t30-,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	15	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 30: 1224-8 (1987) BindingDB Entry DOI: 10.7270/Q2X63NJ7
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022959 (CHEMBL3143454 | {1-[1-[1-Cyclohexylmethyl-2-hydrox...) Show SMILES CC(C)CCC(=O)NCC[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/C37H58N6O6/c1-25(2)16-17-33(45)39-19-18-32(44)29(20-26-12-8-6-9-13-26)41-35(47)31(22-28-23-38-24-40-28)42-34(46)30(21-27-14-10-7-11-15-27)43-36(48)49-37(3,4)5/h7,10-11,14-15,23-26,29-32,44H,6,8-9,12-13,16-22H2,1-5H3,(H,38,40)(H,39,45)(H,41,47)(H,42,46)(H,43,48)/t29-,30?,31?,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	15	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 30: 1224-8 (1987) BindingDB Entry DOI: 10.7270/Q2X63NJ7
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022963 ((1-{1-[1-Cyclohexylmethyl-2-hydroxy-4-(4-methyl-pe...) Show SMILES CC(C)CCC(=O)NCC[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/C40H60N4O6/c1-28(2)21-22-36(46)41-24-23-35(45)32(25-29-15-9-6-10-16-29)42-37(47)33(26-30-17-11-7-12-18-30)43-38(48)34(27-31-19-13-8-14-20-31)44-39(49)50-40(3,4)5/h7-8,11-14,17-20,28-29,32-35,45H,6,9-10,15-16,21-27H2,1-5H3,(H,41,46)(H,42,47)(H,43,48)(H,44,49)/t32-,33?,34?,35-/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	15	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 30: 1224-8 (1987) BindingDB Entry DOI: 10.7270/Q2X63NJ7
					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))	BDBM50023064 (CHEMBL297628 | N-{1-[1-[1-Cyclohexylmethyl-2-hydro...) Show SMILES CC(C)S(=O)(=O)CC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC(C)(C)C Show InChI InChI=1S/C35H55N5O6S/c1-24(2)47(45,46)17-16-31(41)28(18-25-12-8-6-9-13-25)39-34(44)30(20-27-22-36-23-37-27)40-33(43)29(19-26-14-10-7-11-15-26)38-32(42)21-35(3,4)5/h7,10-11,14-15,22-25,28-31,41H,6,8-9,12-13,16-21H2,1-5H3,(H,36,37)(H,38,42)(H,39,44)(H,40,43)/t28-,29-,30-,31-/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	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against human plasma renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50012747 (CHEMBL3143416 | {3-[2-(2-tert-Butoxycarbonylamino-...) Show SMILES COP(=O)(C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)OC Show InChI InChI=1S/C31H52N3O8P/c1-21(2)17-25(28(36)32-24(18-22-13-9-7-10-14-22)27(35)20-43(39,40)41-6)33-29(37)26(19-23-15-11-8-12-16-23)34-30(38)42-31(3,4)5/h8,11-12,15-16,21-22,24-27,35H,7,9-10,13-14,17-20H2,1-6H3,(H,32,36)(H,33,37)(H,34,38)(H,39,40)/t24-,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	20	n/a	n/a	n/a	n/a	6.0	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of purified human renal renin at pH 6.				J Med Chem 33: 534-42 (1990) BindingDB Entry DOI: 10.7270/Q2125RMP
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023061 ((1-{1-[1-Cyclohexylmethyl-2-hydroxy-4-(propane-2-s...) Show SMILES CC(C)S(=O)(=O)CC[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/C37H55N3O7S/c1-26(2)48(45,46)22-21-33(41)30(23-27-15-9-6-10-16-27)38-34(42)31(24-28-17-11-7-12-18-28)39-35(43)32(25-29-19-13-8-14-20-29)40-36(44)47-37(3,4)5/h7-8,11-14,17-20,26-27,30-33,41H,6,9-10,15-16,21-25H2,1-5H3,(H,38,42)(H,39,43)(H,40,44)/t30-,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	20	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against purified human renal renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022964 ((1-{1-[1-Cyclohexylmethyl-2-hydroxy-4-(4-methyl-pe...) Show SMILES CC(C)CCC(=O)NCC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1ccncc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C39H59N5O6/c1-27(2)16-17-35(46)41-23-20-34(45)31(24-28-12-8-6-9-13-28)42-36(47)32(26-30-18-21-40-22-19-30)43-37(48)33(25-29-14-10-7-11-15-29)44-38(49)50-39(3,4)5/h7,10-11,14-15,18-19,21-22,27-28,31-34,45H,6,8-9,12-13,16-17,20,23-26H2,1-5H3,(H,41,46)(H,42,47)(H,43,48)(H,44,49)/t31-,32?,33?,34-/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	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 30: 1224-8 (1987) BindingDB Entry DOI: 10.7270/Q2X63NJ7
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022957 (CHEMBL3143461 | {1-[1-[1-Cyclohexylmethyl-2-hydrox...) Show SMILES CC(C)CC(=O)NCC[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/C36H56N6O6/c1-24(2)18-32(44)38-17-16-31(43)28(19-25-12-8-6-9-13-25)40-34(46)30(21-27-22-37-23-39-27)41-33(45)29(20-26-14-10-7-11-15-26)42-35(47)48-36(3,4)5/h7,10-11,14-15,22-25,28-31,43H,6,8-9,12-13,16-21H2,1-5H3,(H,37,39)(H,38,44)(H,40,46)(H,41,45)(H,42,47)/t28-,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	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 30: 1224-8 (1987) BindingDB Entry DOI: 10.7270/Q2X63NJ7
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023057 (CHEMBL300036 | {1-[1-[1-Cyclohexylmethyl-2-hydroxy...) Show SMILES CCOC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](Cc1cnc[nH]1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCS(=O)(=O)C(C)C Show InChI InChI=1S/C32H49N5O7S/c1-4-44-32(41)37-27(18-24-13-9-6-10-14-24)30(39)36-28(19-25-20-33-21-34-25)31(40)35-26(17-23-11-7-5-8-12-23)29(38)15-16-45(42,43)22(2)3/h6,9-10,13-14,20-23,26-29,38H,4-5,7-8,11-12,15-19H2,1-3H3,(H,33,34)(H,35,40)(H,36,39)(H,37,41)/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	23	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against purified human renal renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023062 (((S)-1-{(S)-1-[1-Cyclohexylmethyl-2-hydroxy-4-((S)...) Show SMILES CC(C)S(=O)(=O)CC[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/C34H53N5O7S/c1-23(2)47(44,45)17-16-30(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)46-34(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 PC cid PC sid UniChem Similars	PubMed	n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against human plasma renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023070 (CHEMBL300724 | {1-[1-(1-Cyclohexylmethyl-4-ethanes...) Show SMILES CCS(=O)(=O)CC[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/C33H51N5O7S/c1-5-46(43,44)17-16-29(39)26(18-23-12-8-6-9-13-23)36-31(41)28(20-25-21-34-22-35-25)37-30(40)27(19-24-14-10-7-11-15-24)38-32(42)45-33(2,3)4/h7,10-11,14-15,21-23,26-29,39H,5-6,8-9,12-13,16-20H2,1-4H3,(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	28	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against human plasma renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022967 ((1-{1-[1-Cyclohexylmethyl-2-hydroxy-4-(4-methyl-pe...) Show SMILES CC(C)CCC(=O)NCC[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/C34H56N4O6/c1-23(2)17-18-30(40)35-20-19-29(39)27(21-25-13-9-7-10-14-25)37-31(41)24(3)36-32(42)28(22-26-15-11-8-12-16-26)38-33(43)44-34(4,5)6/h8,11-12,15-16,23-25,27-29,39H,7,9-10,13-14,17-22H2,1-6H3,(H,35,40)(H,36,42)(H,37,41)(H,38,43)/t24?,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	30	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 30: 1224-8 (1987) BindingDB Entry DOI: 10.7270/Q2X63NJ7
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022962 (CHEMBL3143456 | {1-[1-[1-Cyclohexylmethyl-2-hydrox...) Show SMILES CC(C)CCC(=O)NC[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/C36H56N6O6/c1-24(2)16-17-32(44)38-22-31(43)28(18-25-12-8-6-9-13-25)40-34(46)30(20-27-21-37-23-39-27)41-33(45)29(19-26-14-10-7-11-15-26)42-35(47)48-36(3,4)5/h7,10-11,14-15,21,23-25,28-31,43H,6,8-9,12-13,16-20,22H2,1-5H3,(H,37,39)(H,38,44)(H,40,46)(H,41,45)(H,42,47)/t28-,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	35	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 30: 1224-8 (1987) BindingDB Entry DOI: 10.7270/Q2X63NJ7
					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))	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))	BDBM50012755 (CHEMBL3143418 | {3-[2-(2-tert-Butoxycarbonylamino-...) Show SMILES COP(=O)(C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)OC Show InChI InChI=1S/C32H50N5O8P/c1-32(2,3)45-31(41)37-26(17-23-14-10-7-11-15-23)29(39)36-27(18-24-19-33-21-34-24)30(40)35-25(16-22-12-8-6-9-13-22)28(38)20-46(42,43-4)44-5/h7,10-11,14-15,19,21-22,25-28,38H,6,8-9,12-13,16-18,20H2,1-5H3,(H,33,34)(H,35,40)(H,36,39)(H,37,41)/t25-,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	39	n/a	n/a	n/a	n/a	6.0	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of purified human renal renin at pH 6.				J Med Chem 33: 534-42 (1990) BindingDB Entry DOI: 10.7270/Q2125RMP
					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))	BDBM50023059 (CHEMBL45727 | [1-[1-[1-Cyclohexylmethyl-2-hydroxy-...) Show SMILES COc1ccc(C[C@H](NC(=O)OC(C)(C)C)C(=O)N[C@@H](Cc2cnc[nH]2)C(=O)N[C@@H](CC2CCCCC2)[C@@H](O)CCS(=O)(=O)C(C)C)cc1 Show InChI InChI=1S/C35H55N5O8S/c1-23(2)49(45,46)17-16-31(41)28(18-24-10-8-7-9-11-24)38-33(43)30(20-26-21-36-22-37-26)39-32(42)29(40-34(44)48-35(3,4)5)19-25-12-14-27(47-6)15-13-25/h12-15,21-24,28-31,41H,7-11,16-20H2,1-6H3,(H,36,37)(H,38,43)(H,39,42)(H,40,44)/t28-,29-,30-,31-/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	41	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against human plasma renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50012749 (CHEMBL3143423 | {4-Cyclohexyl-3-[2-[2-(3,3-dimethy...) Show SMILES COP(=O)(C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)CC(C)(C)C)OC Show InChI InChI=1S/C33H52N5O7P/c1-33(2,3)19-30(40)36-27(17-24-14-10-7-11-15-24)31(41)38-28(18-25-20-34-22-35-25)32(42)37-26(16-23-12-8-6-9-13-23)29(39)21-46(43,44-4)45-5/h7,10-11,14-15,20,22-23,26-29,39H,6,8-9,12-13,16-19,21H2,1-5H3,(H,34,35)(H,36,40)(H,37,42)(H,38,41)/t26-,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	47	n/a	n/a	n/a	n/a	6.0	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of purified human renal renin at pH 6.				J Med Chem 33: 534-42 (1990) BindingDB Entry DOI: 10.7270/Q2125RMP
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022966 (CHEMBL3143348 | {1-[1-[1-Cyclohexylmethyl-2-hydrox...) Show SMILES CC(C)CC(=O)NC[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/C35H54N6O6/c1-23(2)16-31(43)37-21-30(42)27(17-24-12-8-6-9-13-24)39-33(45)29(19-26-20-36-22-38-26)40-32(44)28(18-25-14-10-7-11-15-25)41-34(46)47-35(3,4)5/h7,10-11,14-15,20,22-24,27-30,42H,6,8-9,12-13,16-19,21H2,1-5H3,(H,36,38)(H,37,43)(H,39,45)(H,40,44)(H,41,46)/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	50	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 30: 1224-8 (1987) BindingDB Entry DOI: 10.7270/Q2X63NJ7
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50012746 (CHEMBL3143422 | {4-Cyclohexyl-3-[2-(2-ethoxycarbon...) 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)CP(=O)(OC)OC Show InChI InChI=1S/C30H46N5O8P/c1-4-43-30(39)35-25(16-22-13-9-6-10-14-22)28(37)34-26(17-23-18-31-20-32-23)29(38)33-24(15-21-11-7-5-8-12-21)27(36)19-44(40,41-2)42-3/h6,9-10,13-14,18,20-21,24-27,36H,4-5,7-8,11-12,15-17,19H2,1-3H3,(H,31,32)(H,33,38)(H,34,37)(H,35,39)/t24-,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	50	n/a	n/a	n/a	n/a	6.0	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of purified human renal renin at pH 6.				J Med Chem 33: 534-42 (1990) BindingDB Entry DOI: 10.7270/Q2125RMP
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50012751 (CHEMBL3143425 | {3-[2-(2-tert-Butoxycarbonylamino-...) Show SMILES CCOP(=O)(C[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)OCC Show InChI InChI=1S/C34H54N5O8P/c1-6-45-48(44,46-7-2)22-30(40)27(18-24-14-10-8-11-15-24)37-32(42)29(20-26-21-35-23-36-26)38-31(41)28(19-25-16-12-9-13-17-25)39-33(43)47-34(3,4)5/h9,12-13,16-17,21,23-24,27-30,40H,6-8,10-11,14-15,18-20,22H2,1-5H3,(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	72	n/a	n/a	n/a	n/a	6.0	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of purified human renal renin at pH 6.				J Med Chem 33: 534-42 (1990) BindingDB Entry DOI: 10.7270/Q2125RMP
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023065 ((1-{1-[1-Cyclohexylmethyl-2-hydroxy-4-(propane-2-s...) Show SMILES CC(C)S(=O)(=O)CC[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/C31H51N3O7S/c1-21(2)42(39,40)18-17-27(35)25(19-23-13-9-7-10-14-23)33-28(36)22(3)32-29(37)26(20-24-15-11-8-12-16-24)34-30(38)41-31(4,5)6/h8,11-12,15-16,21-23,25-27,35H,7,9-10,13-14,17-20H2,1-6H3,(H,32,37)(H,33,36)(H,34,38)/t22-,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	76	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against purified human renal renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023058 ((1-{1-[1-Cyclohexylmethyl-2-hydroxy-4-(propane-2-s...) Show SMILES CC(C)C[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)CCS(=O)(=O)C(C)C Show InChI InChI=1S/C34H57N3O7S/c1-23(2)20-28(36-32(40)29(22-26-16-12-9-13-17-26)37-33(41)44-34(5,6)7)31(39)35-27(21-25-14-10-8-11-15-25)30(38)18-19-45(42,43)24(3)4/h9,12-13,16-17,23-25,27-30,38H,8,10-11,14-15,18-22H2,1-7H3,(H,35,39)(H,36,40)(H,37,41)/t27-,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	77	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against purified human renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50012752 (CHEMBL3143414 | {1-[1-[1-Cyclohexylmethyl-2-hydrox...) 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)CP1(=O)OCCCO1 Show InChI InChI=1S/C33H50N5O8P/c1-33(2,3)46-32(42)38-27(18-24-13-8-5-9-14-24)30(40)37-28(19-25-20-34-22-35-25)31(41)36-26(17-23-11-6-4-7-12-23)29(39)21-47(43)44-15-10-16-45-47/h5,8-9,13-14,20,22-23,26-29,39H,4,6-7,10-12,15-19,21H2,1-3H3,(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 KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	80	n/a	n/a	n/a	n/a	6.0	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of purified human renal renin at pH 6.				J Med Chem 33: 534-42 (1990) BindingDB Entry DOI: 10.7270/Q2125RMP
					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))	BDBM50012745 (CHEMBL3143420 | {3-[2-(2-tert-Butoxycarbonylamino-...) Show SMILES COP(=O)(C[C@@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)OC Show InChI InChI=1S/C32H50N5O8P/c1-32(2,3)45-31(41)37-26(17-23-14-10-7-11-15-23)29(39)36-27(18-24-19-33-21-34-24)30(40)35-25(16-22-12-8-6-9-13-22)28(38)20-46(42,43-4)44-5/h7,10-11,14-15,19,21-22,25-28,38H,6,8-9,12-13,16-18,20H2,1-5H3,(H,33,34)(H,35,40)(H,36,39)(H,37,41)/t25-,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	90	n/a	n/a	n/a	n/a	6.0	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition of purified human renal renin at pH 6.				J Med Chem 33: 534-42 (1990) BindingDB Entry DOI: 10.7270/Q2125RMP
					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))	BDBM50022965 (CHEMBL3143459 | {1-[1-[1-Cyclohexylmethyl-2-hydrox...) Show SMILES CC(C)CCC(=O)NCC[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cncn1C)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C Show InChI InChI=1S/C38H60N6O6/c1-26(2)17-18-34(46)40-20-19-33(45)30(21-27-13-9-7-10-14-27)41-36(48)32(23-29-24-39-25-44(29)6)42-35(47)31(22-28-15-11-8-12-16-28)43-37(49)50-38(3,4)5/h8,11-12,15-16,24-27,30-33,45H,7,9-10,13-14,17-23H2,1-6H3,(H,40,46)(H,41,48)(H,42,47)(H,43,49)/t30-,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	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 30: 1224-8 (1987) BindingDB Entry DOI: 10.7270/Q2X63NJ7
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50022955 (CHEMBL3143460 | {1-[1-[1-Cyclohexylmethyl-4-(2-dim...) Show SMILES CN(C)CC(=O)NCC[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/C35H55N7O6/c1-35(2,3)48-34(47)41-28(19-25-14-10-7-11-15-25)32(45)40-29(20-26-21-36-23-38-26)33(46)39-27(18-24-12-8-6-9-13-24)30(43)16-17-37-31(44)22-42(4)5/h7,10-11,14-15,21,23-24,27-30,43H,6,8-9,12-13,16-20,22H2,1-5H3,(H,36,38)(H,37,44)(H,39,46)(H,40,45)(H,41,47)/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	100	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 30: 1224-8 (1987) BindingDB Entry DOI: 10.7270/Q2X63NJ7
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023063 (CHEMBL301528 | {1-[1-(1-Cyclohexylmethyl-4-ethanes...) Show SMILES CCS(=O)(=O)CC[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/C30H49N3O7S/c1-6-41(38,39)18-17-26(34)24(19-22-13-9-7-10-14-22)32-27(35)21(2)31-28(36)25(20-23-15-11-8-12-16-23)33-29(37)40-30(3,4)5/h8,11-12,15-16,21-22,24-26,34H,6-7,9-10,13-14,17-20H2,1-5H3,(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	140	n/a	n/a	n/a	n/a	n/a	n/a
Abbott Laboratories Curated by ChEMBL					Assay Description Inhibition against human plasma renin				J Med Chem 30: 1729-37 (1987) BindingDB Entry DOI: 10.7270/Q2MK6BW4
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50023031 (CHEMBL3144129 | {1-[1-(2-Hydroxy-1-isobutyl-5-meth...) Show SMILES CC(C)CC[C@@H](O)[C@@H](CC(C)C)NC(=O)[C@H](Cc1c[nH]cn1)NC(=O)[C@H](Cc1cccc2ccccc12)NC(=O)OC(C)(C)C Show InChI InChI=1S/C35H51N5O5/c1-22(2)15-16-31(41)28(17-23(3)4)38-33(43)30(19-26-20-36-21-37-26)39-32(42)29(40-34(44)45-35(5,6)7)18-25-13-10-12-24-11-8-9-14-27(24)25/h8-14,20-23,28-31,41H,15-19H2,1-7H3,(H,36,37)(H,38,43)(H,39,42)(H,40,44)/t28-,29?,30?,31-/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	150	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))	BDBM50022879 (1N-[1-[1-cyclohexyl-2-hydroxy-3-isopropylsulfanyl-...) Show SMILES CC(C)SC[C@H](O)[C@@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C1CCCCC1 Show InChI InChI=1S/C32H49N5O5S/c1-21(2)43-19-27(38)28(23-14-10-7-11-15-23)37-30(40)26(17-24-18-33-20-34-24)35-29(39)25(16-22-12-8-6-9-13-22)36-31(41)42-32(3,4)5/h6,8-9,12-13,18,20-21,23,25-28,38H,7,10-11,14-17,19H2,1-5H3,(H,33,34)(H,35,39)(H,36,41)(H,37,40)/t25-,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	150	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))	BDBM50022878 (1N-[1-[1-benzyl-2-hydroxy-3-isopropylsulfanyl-(1S,...) 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/C30H43N3O5S/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/h7-16,20-21,24-26,34H,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	170	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

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