Reaction Details |
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Target | Renin |
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Ligand | BDBM50311804 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_619906 (CHEMBL1110296) |
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IC50 | 6.4±n/a nM |
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Citation | Remen, L; Bezençon, O; Richard-Bildstein, S; Bur, D; Prade, L; Corminboeuf, O; Boss, C; Grisostomi, C; Sifferlen, T; Strickner, P; Hess, P; Delahaye, S; Treiber, A; Weller, T; Binkert, C; Steiner, B; Fischli, W New classes of potent and bioavailable human renin inhibitors. Bioorg Med Chem Lett19:6762-5 (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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BDBM50311804 |
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n/a |
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Name | BDBM50311804 |
Synonyms: | (1S,5S)-7-{4-[3-(2-Chloro-3,6-difluoro-phenoxy)-propyl]-phenyl}-3,3-dioxo-3lambda*6*-thia-9-aza-bicyclo[33.1]non-6-ene-6-carboxylic acid cyclopropyl-(2,3-dichloro-benzyl)-amide | CHEMBL1076445 |
Type | Small organic molecule |
Emp. Form. | C33H31Cl3F2N2O4S |
Mol. Mass. | 696.031 |
SMILES | Fc1ccc(F)c(OCCCc2ccc(cc2)C2=C([C@H]3CS(=O)(=O)C[C@H](C2)N3)C(=O)N(Cc2cccc(Cl)c2Cl)C2CC2)c1Cl |r,t:18| |
Structure |
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