Reaction Details Report a problem with these data
Target
Renin
Ligand
BDBM50005433
Substrate
n/a
Meas. Tech.
ChEBML_192717
IC50
2.1±n/a nM
Citation
 Repine, JT; Kaltenbronn, JS; Doherty, AM; Hamby, JM; Himmelsbach, RJ; Kornberg, BE; Taylor, MD; Lunney, EA; Humblet, C; Rapundalo, ST Renin inhibitors containing alpha-heteroatom amino acids as P2 residues. J Med Chem 35:1032-42 (1992) [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:
BDBM50005433
Synonyms:
5-Cyclohexyl-2,2-difluoro-4-{2-[2-(morpholine-4-sulfonylamino)-3-phenyl-propionylamino]-2-propoxy-acetylamino}-3-oxo-pentanoic acid (2-morpholin-4-yl-ethyl)-amide | CHEMBL267955
Type:
Small organic molecule
Emp. Form.:
C35H54F2N6O9S
Mol. Mass.:
772.9
SMILES:
CCCOC(NC(=O)[C@H](Cc1ccccc1)NS(=O)(=O)N1CCOCC1)C(=O)N[C@@H](CC1CCCCC1)C(=O)C(F)(F)C(=O)NCCN1CCOCC1
Structure:
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