| Reaction Details |
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 | Report a problem with these data |
| Target | Renin |
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| Ligand | BDBM50285792 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEBML_195935 |
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| IC50 | 0.300000±n/a nM |
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| Citation |  Lefker, BA; Hada, WA; Wright, AS; Martin, WH; Stock, IA; Schulte, GK; Pandit, J; Danley, DE; Ammirati, MJ; Sneddon, SF Rational design, synthesis, and X-ray structure of renin inhibitors with extended P1 sidechains Bioorg Med Chem Lett5:2623-2626 (1995) 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 |
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| Synonyms: | Angiotensinogenase | REN | RENI_HUMAN |
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| Type: | Enzyme |
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| Mol. Mass.: | 45058.99 |
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| Organism: | Homo sapiens (Human) |
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| Description: | n/a |
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| Residue: | 406 |
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| Sequence: | MDGWRRMPRWGLLLLLWGSCTFGLPTDTTTFKRIFLKRMPSIRESLKERGVDMARLGPEW
SQPMKRLTLGNTTSSVILTNYMDTQYYGEIGIGTPPQTFKVVFDTGSSNVWVPSSKCSRL
YTACVYHKLFDASDSSSYKHNGTELTLRYSTGTVSGFLSQDIITVGGITVTQMFGEVTEM
PALPFMLAEFDGVVGMGFIEQAIGRVTPIFDNIISQGVLKEDVFSFYYNRDSENSQSLGG
QIVLGGSDPQHYEGNFHYINLIKTGVWQIQMKGVSVGSSTLLCEDGCLALVDTGASYISG
STSSIEKLMEALGAKKRLFDYVVKCNEGPTLPDISFHLGGKEYTLTSADYVFQESYSSKK
LCTLAIHAMDIPPPTGPTWALGATFIRKFYTEFDRRNNRIGFALAR
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| BDBM50285792 |
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| n/a |
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| Name | BDBM50285792 |
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| Synonyms: | 4-Oxo-piperidine-1-carboxylic acid {(S)-1-[(R)-1-((1S,2R,3S)-1-cyclohexylmethyl-2,3-dihydroxy-5-methyl-hexylcarbamoyl)-2-methylsulfanyl-ethylcarbamoyl]-2-phenyl-ethyl}-amide | CHEMBL89235 |
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| Type | Small organic molecule |
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| Emp. Form. | C33H52N4O6S |
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| Mol. Mass. | 632.854 |
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| SMILES | CSC[C@H](NC(=O)[C@H](Cc1ccccc1)NC(=O)N1CCC(=O)CC1)C(=O)N[C@@H](CC1CCCCC1)[C@@H](O)[C@@H](O)CC(C)C |
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| Structure | 
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