Reaction Details Report a problem with these data
Target
Renin
Ligand
BDBM50014105
Substrate
n/a
Meas. Tech.
ChEBML_196424
IC50
0.330000±n/a nM
Citation
 Bundy, GL; Pals, DT; Lawson, JA; Couch, SJ; Lipton, MF; Mauragis, MA Potent renin inhibitory peptides containing hydrophilic end groups. J Med Chem 33:2276-83 (1990) [PubMed]  Article 
Target
Name:
Renin
Synonyms:
RENI_RAT | Ren | Ren1
Type:
PROTEIN
Mol. Mass.:
44272.67
Organism:
Rattus norvegicus
Description:
ChEMBL_222765
Residue:
402
Sequence:
MGGRRMPLWALLLLWTSCSFSLPTDTASFGRILLKKMPSVREILEERGVDMTRISAEWGEFIKKSSFTNVTSPVVLTNYLDTQYYGEIGIGTPSQTFKVIFDTGSANLWVPSTKCGPLYTACEIHNLYDSSESSSYMENGTEFTIHYGSGKVKGFLSQDVVTVGGIIVTQTFGEVTELPLIPFMLAKFDGVLGMGFPAQAVDGVIPVFDHILSQRVLKEEVFSVYYSRESHLLGGEVVLGGSDPQHYQGNFHYVSISKAGSWQITMKGVSVGPATLLCEEGCMAVVDTGTSYISGPTSSLQLIMQALGVKEKRANNYVVNCSQVPTLPDISFYLGGRTYTLSNMDYVQKNPFRNDDLCILALQGLDIPPPTGPVWVLGATFIRKFYTEFDRHNNRIGFALAR
  
Inhibitor
Name:
BDBM50014105
Synonyms:
2-(1-{[1-{2-Hydroxy-1-isobutyl-5-methyl-4-[2-methyl-1-(2-methylamino-pyridin-1-yloxycarbonyl)-butylcarbamoyl]-hexylcarbamoyl}-2-(1H-imidazol-4-yl)-ethyl]-methyl-carbamoyl}-2-phenyl-ethylcarbamoyl)-pyrrolidine-1-carboxylic acid tert-butyl ester | CHEMBL415615
Type:
Small organic molecule
Emp. Form.:
C50H74N8O9
Mol. Mass.:
931.1708
SMILES:
CC[C@H](C)[C@H](NC(=O)[C@H](C[C@H](O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc[nH]1)N(C)C(=O)[C@H](Cc1ccccc1)NC(=O)[C@@H]1CCCN1C(=O)OC(C)(C)C)C(C)C)C(=O)OCc1ccccn1
Structure:
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