Reaction Details Report a problem with these data
Target
Renin
Ligand
BDBM50023092
Substrate
n/a
Meas. Tech.
ChEMBL_196264 (CHEMBL803241)
Ki
28±n/a nM
Citation
Bock, MG; DiPardo, RM; Evans, BE; Rittle, KE; Boger, J; Poe, M; LaMont, BI; Lynch, RJ; Ulm, EH; Vlasuk, GP Renin inhibitors. Statine-containing tetrapeptides with varied hydrophobic carboxy termini. J Med Chem 30:1853-7 (1987) [PubMed] Article
More Info.:
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:
BDBM50023092
Synonyms:
Boc-Phe-His-Sta-Leu-(+)-1,2-diphenylthylamide | Boc-Phe-His-Sta-Leu-(-)-1,2-diphenylthylamide | Boc-Phe-His-Sta-Leu-(-)-alpha-phenylthylamide | CHEMBL53112
Type:
Small organic molecule
Emp. Form.:
C48H65N7O7
Mol. Mass.:
852.0724
SMILES:
CC(C)CC(NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(O)CC(=O)N[C@@H](CC(C)C)C(=O)NC(Cc1ccccc1)c1ccccc1