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Target
Renin
Ligand
BDBM50165800
Substrate
n/a
Meas. Tech.
ChEMBL_304632 (CHEMBL828516)
IC50
17±n/a nM
Citation
 Powell, NA; Clay, EH; Holsworth, DD; Bryant, JW; Ryan, MJ; Jalaie, M; Zhang, E; Edmunds, JJ Equipotent activity in both enantiomers of a series of ketopiperazine-based renin inhibitors. Bioorg Med Chem Lett 15:2371-4 (2005) [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:
BDBM50165800
Synonyms:
7-((S)-1-{4-[3-(2-Methoxy-benzyloxy)-propoxy]-phenyl}-6-oxo-piperazin-2-ylmethoxy)-1-(3-methoxy-propyl)-3,4-dihydro-1H-quinolin-2-one | CHEMBL193324
Type:
Small organic molecule
Emp. Form.:
C35H43N3O7
Mol. Mass.:
617.7318
SMILES:
COCCCN1C(=O)CCc2ccc(OC[C@@H]3CNCC(=O)N3c3ccc(OCCCOCc4ccccc4OC)cc3)cc12
Structure:
Search PDB for entries with ligand similarity: