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TargetRenin
LigandBDBM50014071
Substrate/Competitorn/a
Meas. Tech.ChEMBL_195943 (CHEMBL801669)
pH7.4±n/a
IC50 7.3±n/a nM
Commentsextracted
Citation Rosenberg, SHWoods, KWSham, HLKleinert, HDMartin, DLStein, HCohen, JEgan, DABopp, BMerits, I Water-soluble renin inhibitors: design of a subnanomolar inhibitor with a prolonged duration of action. J Med Chem33:1962-9 (1990) [PubMed]
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
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  Blast E-value cutoff:
BDBM50014071
n/a
NameBDBM50014071
Synonyms:(R)-2-Benzyl-4-[(3R,4S)-3,4-bis-(2-methoxy-ethoxymethoxy)-pyrrolidin-1-yl]-N-[(S)-1-[(1S,2R)-1-cyclohexylmethyl-2-((S)-3-ethyl-2-oxo-oxazolidin-5-yl)-2-hydroxy-ethylcarbamoyl]-2-(3H-imidazol-4-yl)-ethyl]-4-oxo-butyramide | CHEMBL59135
TypeSmall organic molecule
Emp. Form.C43H66N6O12
Mol. Mass.859.0171
SMILESCCN1C[C@H](OC1=O)[C@H](O)[C@H](CC1CCCCC1)NC(=O)[C@H](Cc1cnc[nH]1)NC(=O)[C@@H](CC(=O)N1C[C@@H](OCOCCOC)[C@H](C1)OCOCCOC)Cc1ccccc1
Structure
Search PDB for entries with ligand similarity:Similarity to this molecule at least: