BDBM50330361 (2S)-2-((S)-2-((2R,3S)-3-amino-6-(biphenyl-4-yl)-2-hydroxyhexylamino)-3-methylbutanamido)-4-methyl-N-(3-phenylpropyl)hexanamide::CHEMBL1276273

SMILES: CCC(C)C[C@H](NC(=O)[C@@H](NC[C@@H](O)[C@@H](N)CCCc1ccc(cc1)-c1ccccc1)C(C)C)C(=O)NCCCc1ccccc1

InChI Key: InChIKey=BTJIOQIVSIPVBA-XIWJLPDVSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50330361   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Renin (Homo sapiens (Human))	BDBM50330361 ((2S)-2-((S)-2-((2R,3S)-3-amino-6-(biphenyl-4-yl)-2...) Show SMILES CCC(C)C[C@H](NC(=O)[C@@H](NC[C@@H](O)[C@@H](N)CCCc1ccc(cc1)-c1ccccc1)C(C)C)C(=O)NCCCc1ccccc1 |r| Show InChI InChI=1S/C39H56N4O3/c1-5-29(4)26-35(38(45)41-25-13-17-30-14-8-6-9-15-30)43-39(46)37(28(2)3)42-27-36(44)34(40)20-12-16-31-21-23-33(24-22-31)32-18-10-7-11-19-32/h6-11,14-15,18-19,21-24,28-29,34-37,42,44H,5,12-13,16-17,20,25-27,40H2,1-4H3,(H,41,45)(H,43,46)/t29?,34-,35-,36+,37-/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	4	n/a	n/a	n/a	n/a	7.4	n/a
Novartis Pharmaceuticals Corp Curated by ChEMBL					Assay Description Inhibition of renin in pH 7.4 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