Reaction Details |
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Target | Renin |
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Ligand | BDBM50259463 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_501175 (CHEMBL975288) |
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IC50 | 2.3±n/a nM |
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Citation | Bezençon, O; Bur, D; Weller, T; Richard-Bildstein, S; Remen, L; Sifferlen, T; Corminboeuf, O; Grisostomi, C; Boss, C; Prade, L; Delahaye, S; Treiber, A; Strickner, P; Binkert, C; Hess, P; Steiner, B; Fischli, W Design and preparation of potent, nonpeptidic, bioavailable renin inhibitors. J Med Chem52:3689-702 (2009) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Renin |
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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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BDBM50259463 |
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n/a |
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Name | BDBM50259463 |
Synonyms: | (rac)-7-(4-{2-[Methyl-(2,3,6-trichloro-benzyl)-amino]-ethyl}-phenyl)-3,9-diazabicyclo[3.3.1]non-6-ene-6-carboxylic acid cyclopropyl-(3-methoxy-2-methyl-benzyl)-amide | CHEMBL446741 |
Type | Small organic molecule |
Emp. Form. | C36H41Cl3N4O2 |
Mol. Mass. | 668.095 |
SMILES | COc1cccc(CN(C2CC2)C(=O)C2=C(CC3CNCC2N3)c2ccc(CCN(C)Cc3c(Cl)ccc(Cl)c3Cl)cc2)c1C |t:15,TLB:23:15:22:19.20.18,THB:12:14:22:19.20.18| |
Structure |
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