BDBM50024157 (1-{1-[1-(1-Hydroxy-2-{2-methyl-1-[(pyridin-2-ylmethyl)-carbamoyl]-butylcarbamoyl}-ethyl)-3-methyl-butylcarbamoyl]-1-methyl-2-phenyl-ethylcarbamoyl}-2-phenyl-ethyl)-carbamic acid tert-butyl ester::CHEMBL303344::CHEMBL3142189

SMILES: CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@](C)(Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1ccccn1

InChI Key: InChIKey=SOCJYLMGQLCRAC-UHFFFAOYSA-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 = 50024157   

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))	BDBM50024157 ((1-{1-[1-(1-Hydroxy-2-{2-methyl-1-[(pyridin-2-ylme...) Show SMILES CC[C@H](C)[C@H](NC(=O)C[C@H](O)[C@H](CC(C)C)NC(=O)[C@](C)(Cc1ccccc1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)NCc1ccccn1 |r| Show InChI InChI=1S/C44H62N6O7/c1-9-30(4)38(40(54)46-28-33-22-16-17-23-45-33)49-37(52)26-36(51)34(24-29(2)3)47-41(55)44(8,27-32-20-14-11-15-21-32)50-39(53)35(25-31-18-12-10-13-19-31)48-42(56)57-43(5,6)7/h10-23,29-30,34-36,38,51H,9,24-28H2,1-8H3,(H,46,54)(H,47,55)(H,48,56)(H,49,52)(H,50,53)	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	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
TBA Curated by ChEMBL					Assay Description Inhibition of human plasma renin				J Med Chem 29: 2088-93 (1986) BindingDB Entry DOI: 10.7270/Q2251JRT
					More data for this Ligand-Target Pair