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TargetRenin
LigandBDBM50340410
Substrate/Competitorn/a
Meas. Tech.ChEMBL_741046 (CHEMBL1764274)
pH7.4±n/a
IC50 0.022±n/a nM
Commentsextracted
Citation Aspiotis, RChen, ACauchon, EDubé, DFalgueyret, JPGagné, SGallant, MGrimm, ELHoule, RJuteau, HLacombe, PLaliberté, SLévesque, JFMacDonald, DMcKay, DPercival, MDRoy, PSoisson, SMWu, T The discovery and synthesis of potent zwitterionic inhibitors of renin. Bioorg Med Chem Lett21:2430-6 (2011) [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:
BDBM50340410
n/a
NameBDBM50340410
Synonyms:(3R,4S)-N-cyclopropyl-4-(4-(2-(2,6-dichloro-4-methylphenoxy)ethoxy)phenyl)-N-(3-(3-(3-ethylureido)propoxy)-5-(3-methoxypropyl)benzyl)piperidine-3-carboxamide | CHEMBL1761522
TypeSmall organic molecule
Emp. Form.C41H54Cl2N4O6
Mol. Mass.769.797
SMILESCCNC(=O)NCCCOc1cc(CCCOC)cc(CN(C2CC2)C(=O)[C@H]2CNCC[C@@H]2c2ccc(OCCOc3c(Cl)cc(C)cc3Cl)cc2)c1 |r|
Structure
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