BDBM50016050 CHEMBL352937::{1-[3-({1-[2-(1-Benzylcarbamoyl-3-methyl-butylcarbamoyl)-1-hydroxy-ethyl]-3-methyl-butylcarbamoyl}-methyl)-oxiranyl]-2-phenyl-ethyl}-carbamic acid tert-butyl ester::{1-[3-({1-[2-(1-Benzylcarbamoyl-3-methyl-butylcarbamoyl)-1-hydroxy-ethyl]-3-methyl-butylcarbamoyl}-methyl)-oxiranyl]-2-phenyl-ethyl}-carbamic acid tert-butyl ester : (0.15 chloroform)

SMILES: CC(C)C[C@H](NC(=O)CC1OC1[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(O)CC(=O)N[C@@H](CC(C)C)C(=O)NCc1ccccc1

InChI Key: InChIKey=ISCXAZPFTZSBGC-HXHNTATGSA-N

Data: 2 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 2 hits for monomerid = 50016050   

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))	BDBM50016050 (CHEMBL352937 | {1-[3-({1-[2-(1-Benzylcarbamoyl-3-m...) Show SMILES CC(C)C[C@H](NC(=O)CC1OC1[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(O)CC(=O)N[C@@H](CC(C)C)C(=O)NCc1ccccc1 Show InChI InChI=1S/C38H56N4O7/c1-24(2)18-28(31(43)21-33(44)41-30(19-25(3)4)36(46)39-23-27-16-12-9-13-17-27)40-34(45)22-32-35(48-32)29(20-26-14-10-8-11-15-26)42-37(47)49-38(5,6)7/h8-17,24-25,28-32,35,43H,18-23H2,1-7H3,(H,39,46)(H,40,45)(H,41,44)(H,42,47)/t28-,29-,30-,31?,32?,35?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against human renin				J Med Chem 33: 838-45 (1990) BindingDB Entry DOI: 10.7270/Q2T152M6
					More data for this Ligand-Target Pair
Renin (Homo sapiens (Human))	BDBM50016050 (CHEMBL352937 | {1-[3-({1-[2-(1-Benzylcarbamoyl-3-m...) Show SMILES CC(C)C[C@H](NC(=O)CC1OC1[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(O)CC(=O)N[C@@H](CC(C)C)C(=O)NCc1ccccc1 Show InChI InChI=1S/C38H56N4O7/c1-24(2)18-28(31(43)21-33(44)41-30(19-25(3)4)36(46)39-23-27-16-12-9-13-17-27)40-34(45)22-32-35(48-32)29(20-26-14-10-8-11-15-26)42-37(47)49-38(5,6)7/h8-17,24-25,28-32,35,43H,18-23H2,1-7H3,(H,39,46)(H,40,45)(H,41,44)(H,42,47)/t28-,29-,30-,31?,32?,35?/m0/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL KEGG PC cid PC sid UniChem Similars	PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Warner-Lambert Company Curated by ChEMBL					Assay Description Inhibitory activity against human renin				J Med Chem 33: 838-45 (1990) BindingDB Entry DOI: 10.7270/Q2T152M6
					More data for this Ligand-Target Pair