Target
Renin
Ligand
BDBM50009882
Substrate
n/a
Meas. Tech.
ChEMBL_192728 (CHEMBL801755)
IC50
248±n/a nM
Citation
 Doherty, AMKaltenbronn, JSHudspeth, JPRepine, JTRoark, WHSircar, ITinney, FJConnolly, CJHodges, JCTaylor, MD New inhibitors of human renin that contain novel replacements at the P2 site. J Med Chem 34:1258-71 (1991) [PubMed]  Article 
Target
Name:
Renin
Synonyms:
Angiotensinogenase | REN | RENI_HUMAN
Type:
Enzyme
Mol. Mass.:
45058.99
Organism:
Homo sapiens (Human)
Description:
n/a
Residue:
406
Sequence:
MDGWRRMPRWGLLLLLWGSCTFGLPTDTTTFKRIFLKRMPSIRESLKERGVDMARLGPEWSQPMKRLTLGNTTSSVILTNYMDTQYYGEIGIGTPPQTFKVVFDTGSSNVWVPSSKCSRLYTACVYHKLFDASDSSSYKHNGTELTLRYSTGTVSGFLSQDIITVGGITVTQMFGEVTEMPALPFMLAEFDGVVGMGFIEQAIGRVTPIFDNIISQGVLKEDVFSFYYNRDSENSQSLGGQIVLGGSDPQHYEGNFHYINLIKTGVWQIQMKGVSVGSSTLLCEDGCLALVDTGASYISGSTSSIEKLMEALGAKKRLFDYVVKCNEGPTLPDISFHLGGKEYTLTSADYVFQESYSSKKLCTLAIHAMDIPPPTGPTWALGATFIRKFYTEFDRRNNRIGFALAR
  
Inhibitor
Name:
BDBM50009882
Synonyms:
CHEMBL22888 | [5-{1-[1-Hydroxy-2-(2-methyl-butylcarbamoyl)-ethyl]-3-methyl-butylcarbamoyl}-5-(3-naphthalen-1-yl-2-naphthalen-1-ylmethyl-propionylamino)-pent-2-ynyl]-carbamic acid benzyl ester
Type:
Small organic molecule
Emp. Form.:
C51H60N4O6
Mol. Mass.:
825.0453
SMILES:
CCC(C)CNC(=O)C[C@H](O)C(CC(C)C)NC(=O)C(CC#CCNC(=O)OCc1ccccc1)NC(=O)C(Cc1cccc2ccccc12)Cc1cccc2ccccc12
Structure:
Search PDB for entries with ligand similarity: