| Reaction Details |
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 | Report a problem with these data |
| Target | Renin |
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| Ligand | BDBM50009620 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEBML_195978 |
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| pH | 7.4±n/a |
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| IC50 | 610±n/a nM |
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| Comments | extracted |
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| Citation |  Weber, AE; Halgren, TA; Doyle, JJ; Lynch, RJ; Siegl, PK; Parsons, WH; Greenlee, WJ; Patchett, AA Design and synthesis of P2-P1'-linked macrocyclic human renin inhibitors. J Med Chem34:2692-701 (1991) [PubMed] |
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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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| BDBM50009620 |
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| n/a |
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| Name | BDBM50009620 |
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| Synonyms: | CHEMBL431854 | [1-(11-Cyclohexylmethyl-12-hydroxy-5,9,13-trioxo-1-oxa-4,10-diaza-cyclotridec-8-ylcarbamoyl)-2-phenyl-ethyl]-carbamic acid tert-butyl ester |
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| Type | Small organic molecule |
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| Emp. Form. | C31H46N4O8 |
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| Mol. Mass. | 602.7189 |
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| SMILES | CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCC(=O)NCCOC(=O)[C@H](O)[C@H](CC2CCCCC2)NC1=O |
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| Structure | 
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