Reaction Details Report a problem with these data
Target
Renin
Ligand
BDBM50022870
Substrate
n/a
Meas. Tech.
ChEBML_195945
pH
6±n/a
IC50
81±n/a nM
Comments
extracted
Citation
 Luly, JR; Bolis, G; BaMaung, N; Soderquist, J; Dellaria, JF; Stein, H; Cohen, J; Perun, TJ; Greer, J; Plattner, JJ New inhibitors of human renin that contain novel Leu-Val replacements. Examination of the P1 site. J Med Chem 31:532-9 (1988) [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:
BDBM50022870
Synonyms:
1N-[1-[1-[1-hydroxy-2-isopropylsulfanyl-(1R)-ethyl]-3-methyl-(1S)-butylcarbamoyl]-2-(1H-5-imidazolyl)-(1S)-ethyl]-2-aminotertiarybutyloxycarbonyl-3-phenyl-(2S)-propanamide | CHEMBL150298
Type:
Small organic molecule
Emp. Form.:
C30H47N5O5S
Mol. Mass.:
589.79
SMILES:
CC(C)C[C@H](NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@H](Cc1ccccc1)NC(=O)OC(C)(C)C)[C@@H](O)CSC(C)C
Structure:
Search PDB for entries with ligand similarity: