Reaction Details Report a problem with these data
Target
Renin
Ligand
BDBM50014099
Substrate
n/a
Meas. Tech.
ChEBML_196424
IC50
0.490000±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:
BDBM50014099
Synonyms:
CHEMBL414795 | N-[(D-Glucosylamino)carbonyl]-Pro-Phe-N(Me) His-Leu[CHOHCH2]vAL-Ile-AMP
Type:
Small organic molecule
Emp. Form.:
C52H78N10O12
Mol. Mass.:
1035.2355
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)N[C@H]1[C@@H](O)O[C@H](CO)[C@H](O)[C@@H]1O)C(C)C)C(=O)NCc1ccccn1
Structure:
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