Ki Summary BindingDB logo
myBDB logout
Reaction Details
Report a problem with these data
TargetRenin
LigandBDBM50380995
Substrate/Competitorn/a
Meas. Tech.ChEMBL_814100 (CHEMBL2020694)
IC50 0.6±n/a nM
Citation Fournier, PAArbour, MCauchon, EChen, AChefson, ADucharme, YFalgueyret, JPGagné, SGrimm, EHan, YHoule, RLacombe, PLévesque, JFMacDonald, DMackay, BMcKay, DPercival, MDRamtohul, YSt-Jacques, RToulmond, S Design and synthesis of potent, isoxazole-containing renin inhibitors. Bioorg Med Chem Lett22:2670-4 (2012) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Renin
Name:Renin
Synonyms:Angiotensinogenase | REN | RENI_HUMAN
Type:Enzyme
Mol. Mass.:45058.99
Organism:Homo sapiens (Human)
Description:n/a
Residue:406
Sequence:
MDGWRRMPRWGLLLLLWGSCTFGLPTDTTTFKRIFLKRMPSIRESLKERGVDMARLGPEW
SQPMKRLTLGNTTSSVILTNYMDTQYYGEIGIGTPPQTFKVVFDTGSSNVWVPSSKCSRL
YTACVYHKLFDASDSSSYKHNGTELTLRYSTGTVSGFLSQDIITVGGITVTQMFGEVTEM
PALPFMLAEFDGVVGMGFIEQAIGRVTPIFDNIISQGVLKEDVFSFYYNRDSENSQSLGG
QIVLGGSDPQHYEGNFHYINLIKTGVWQIQMKGVSVGSSTLLCEDGCLALVDTGASYISG
STSSIEKLMEALGAKKRLFDYVVKCNEGPTLPDISFHLGGKEYTLTSADYVFQESYSSKK
LCTLAIHAMDIPPPTGPTWALGATFIRKFYTEFDRRNNRIGFALAR
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50380995
n/a
NameBDBM50380995
Synonyms:CHEMBL2017111
TypeSmall organic molecule
Emp. Form.C25H25BrF2N4O3
Mol. Mass.547.392
SMILESCC(=O)NCCc1ccccc1-c1onc([C@H]2CNCC[C@]2(C(N)=O)c2ccc(F)c(F)c2)c1Br |r|
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: