Reaction Details |
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Target | Renin |
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Ligand | BDBM50382336 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_817423 (CHEMBL2027646) |
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IC50 | 4.5±n/a nM |
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Citation | Jia, L; Simpson, RD; Yuan, J; Xu, Z; Zhao, W; Cacatian, S; Tice, CM; Guo, J; Ishchenko, A; Singh, SB; Wu, Z; McKeever, BM; Bukhtiyarov, Y; Johnson, JA; Doe, CP; Harrison, RK; McGeehan, GM; Dillard, LW; Baldwin, JJ; Claremon, DA Discovery of VTP-27999, an Alkyl Amine Renin Inhibitor with Potential for Clinical Utility. ACS Med Chem Lett2:747-751 (2011) [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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BDBM50382336 |
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n/a |
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Name | BDBM50382336 |
Synonyms: | CHEMBL2023122 |
Type | Small organic molecule |
Emp. Form. | C26H41ClN4O5 |
Mol. Mass. | 525.081 |
SMILES | CNC[C@H](C[C@@H]1CCCOC1)NC(=O)N1CCC[C@H](C1)[C@@H](OCCNC(=O)OC)c1cccc(Cl)c1 |r| |
Structure |
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