Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Renin' and Ligand = 'BDBM50285797'   

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))	BDBM50285797 ((R)-2-Acetylamino-N-((1S,2R,3S)-1-biphenyl-3-ylmet...) Show SMILES CSC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1cccc(c1)-c1ccccc1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C26H36N2O4S/c1-17(2)13-24(30)25(31)22(28-26(32)23(16-33-4)27-18(3)29)15-19-9-8-12-21(14-19)20-10-6-5-7-11-20/h5-12,14,17,22-25,30-31H,13,15-16H2,1-4H3,(H,27,29)(H,28,32)/t22-,23-,24-,25+/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	1.60E+3	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))	BDBM50285797 ((R)-2-Acetylamino-N-((1S,2R,3S)-1-biphenyl-3-ylmet...) Show SMILES CSC[C@H](NC(C)=O)C(=O)N[C@@H](Cc1cccc(c1)-c1ccccc1)[C@@H](O)[C@@H](O)CC(C)C Show InChI InChI=1S/C26H36N2O4S/c1-17(2)13-24(30)25(31)22(28-26(32)23(16-33-4)27-18(3)29)15-19-9-8-12-21(14-19)20-10-6-5-7-11-20/h5-12,14,17,22-25,30-31H,13,15-16H2,1-4H3,(H,27,29)(H,28,32)/t22-,23-,24-,25+/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	1.60E+3	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