Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Renin' and Ligand = 'BDBM50285794'   

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))	BDBM50285794 (4-Oxo-piperidine-1-carboxylic acid {[(R)-1-((1S,2R...) Show SMILES CSC[C@H](NC(=O)CNC(=O)N1CCC(=O)CC1)C(=O)N[C@@H](Cc1cccc(c1)-c1ccccc1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C32H44N4O6S/c1-21(2)16-28(38)30(40)26(18-22-8-7-11-24(17-22)23-9-5-4-6-10-23)35-31(41)27(20-43-3)34-29(39)19-33-32(42)36-14-12-25(37)13-15-36/h4-11,17,21,26-28,30,38,40H,12-16,18-20H2,1-3H3,(H,33,42)(H,34,39)(H,35,41)/t26-,27-,28-,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
Novartis Pharmaceuticals Corp Curated by ChEMBL					Assay Description Inhibition of human recombinant renin in buffer				J Med Chem 53: 7490-520 (2010) Article DOI: 10.1021/jm901885s BindingDB Entry DOI: 10.7270/Q2S75GKG
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50285794 (4-Oxo-piperidine-1-carboxylic acid {[(R)-1-((1S,2R...) Show SMILES CSC[C@H](NC(=O)CNC(=O)N1CCC(=O)CC1)C(=O)N[C@@H](Cc1cccc(c1)-c1ccccc1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C32H44N4O6S/c1-21(2)16-28(38)30(40)26(18-22-8-7-11-24(17-22)23-9-5-4-6-10-23)35-31(41)27(20-43-3)34-29(39)19-33-32(42)36-14-12-25(37)13-15-36/h4-11,17,21,26-28,30,38,40H,12-16,18-20H2,1-3H3,(H,33,42)(H,34,39)(H,35,41)/t26-,27-,28-,30+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	Article	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition against recombinant human renin (rHR)				Bioorg Med Chem Lett 5: 2623-2626 (1995) Article DOI: 10.1016/0960-894X(95)00456-4 BindingDB Entry DOI: 10.7270/Q2C24WDC
					More data for this Ligand-Target Pair