Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Renin' and Ligand = 'BDBM50014135'   

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))	BDBM50014135 (6-Amino-2-(3-benzyl-6,6-dimethyl-2,5,9-trioxo-[1,4...) Show SMILES CC(C)CCNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)N1C(=O)CCC(C)(C)C(=O)N[C@@H](Cc2ccccc2)C1=O Show InChI InChI=1S/C38H52N6O5/c1-25(2)18-21-40-34(46)30(23-27-24-41-29-15-9-8-14-28(27)29)42-35(47)32(16-10-11-20-39)44-33(45)17-19-38(3,4)37(49)43-31(36(44)48)22-26-12-6-5-7-13-26/h5-9,12-15,24-25,30-32,41H,10-11,16-23,39H2,1-4H3,(H,40,46)(H,42,47)(H,43,49)/t30-,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	880	n/a	n/a	n/a	n/a	n/a	n/a
ICI Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of human renin				J Med Chem 33: 2560-8 (1990) BindingDB Entry DOI: 10.7270/Q20V8BR8
					More data for this Ligand-Target Pair
Renin (Rattus norvegicus)	BDBM50014135 (6-Amino-2-(3-benzyl-6,6-dimethyl-2,5,9-trioxo-[1,4...) Show SMILES CC(C)CCNC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)[C@H](CCCCN)N1C(=O)CCC(C)(C)C(=O)N[C@@H](Cc2ccccc2)C1=O Show InChI InChI=1S/C38H52N6O5/c1-25(2)18-21-40-34(46)30(23-27-24-41-29-15-9-8-14-28(27)29)42-35(47)32(16-10-11-20-39)44-33(45)17-19-38(3,4)37(49)43-31(36(44)48)22-26-12-6-5-7-13-26/h5-9,12-15,24-25,30-32,41H,10-11,16-23,39H2,1-4H3,(H,40,46)(H,42,47)(H,43,49)/t30-,31-,32-/m0/s1	PDB Reactome pathway KEGG UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
ICI Pharmaceuticals Curated by ChEMBL					Assay Description Inhibitory activity against Porcine renin				J Med Chem 33: 2560-8 (1990) BindingDB Entry DOI: 10.7270/Q20V8BR8
					More data for this Ligand-Target Pair