BDBM50330341 (S)-N-((S)-1-((2S,3R,4S)-1-cyclohexyl-3,4-dihydroxy-6-methylheptan-2-ylamino)-3-(1H-imidazol-4-yl)-1-oxopropan-2-yl)-3-phenylbutanamide::CHEMBL1276462

SMILES: CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)C[C@H](C)c1ccccc1

InChI Key: InChIKey=MJLGUTZCFJYYLS-MCNYKVIWSA-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 = 50330341   

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))	BDBM50330341 ((S)-N-((S)-1-((2S,3R,4S)-1-cyclohexyl-3,4-dihydrox...) Show SMILES CC(C)C[C@H](O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)C[C@H](C)c1ccccc1 |r| Show InChI InChI=1S/C30H46N4O4/c1-20(2)14-27(35)29(37)25(16-22-10-6-4-7-11-22)34-30(38)26(17-24-18-31-19-32-24)33-28(36)15-21(3)23-12-8-5-9-13-23/h5,8-9,12-13,18-22,25-27,29,35,37H,4,6-7,10-11,14-17H2,1-3H3,(H,31,32)(H,33,36)(H,34,38)/t21-,25-,26-,27-,29+/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	11	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