BDBM18272 (2R,4S,5S,7S)-5-amino-N-butyl-7-{[3-(carbamoylmethoxy)-4-methoxyphenyl]methyl}-4-hydroxy-2,8-dimethylnonanamide::8-phenyl-octanecarboxamide peptidomimetic, 29

SMILES: CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)C[C@H](Cc1ccc(OC)c(OCC(N)=O)c1)C(C)C

InChI Key: InChIKey=YIDJPFWGQJGPFB-HZEGPAAWSA-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 = 18272   

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))	BDBM18272 ((2R,4S,5S,7S)-5-amino-N-butyl-7-{[3-(carbamoylmeth...) Show SMILES CCCCNC(=O)[C@H](C)C[C@H](O)[C@@H](N)C[C@H](Cc1ccc(OC)c(OCC(N)=O)c1)C(C)C |r| Show InChI InChI=1S/C25H43N3O5/c1-6-7-10-28-25(31)17(4)11-21(29)20(26)14-19(16(2)3)12-18-8-9-22(32-5)23(13-18)33-15-24(27)30/h8-9,13,16-17,19-21,29H,6-7,10-12,14-15,26H2,1-5H3,(H2,27,30)(H,28,31)/t17-,19+,20+,21+/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	92	n/a	n/a	n/a	n/a	7.2	37
Novartis Pharmaceuticals					Assay Description Enzyme inhibition by test compounds was determined using human recombinant renin, incubating with a synthetic tetradecapeptide substrate. The Ang I g...				J Med Chem 50: 4818-31 (2007) Article DOI: 10.1021/jm070314y BindingDB Entry DOI: 10.7270/Q2MG7MSF
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