| Reaction Details |
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 | Report a problem with these data |
| Target | Protease |
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| Ligand | BDBM50498813 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1523253 (CHEMBL3632388) |
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| Ki | 1.5±n/a nM |
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| Citation |  Ghosh, AK; Takayama, J; Kassekert, LA; Ella-Menye, JR; Yashchuk, S; Agniswamy, J; Wang, YF; Aoki, M; Amano, M; Weber, IT; Mitsuya, H Structure-based design, synthesis, X-ray studies, and biological evaluation of novel HIV-1 protease inhibitors containing isophthalamide-derived P2-ligands. Bioorg Med Chem Lett25:4903-4909 (2015) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Protease |
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| Name: | Protease |
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| Synonyms: | n/a |
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| Type: | Enzyme |
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| Mol. Mass.: | 10904.79 |
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| Organism: | Human immunodeficiency virus 1 (HIV-1) |
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| Description: | Q9YQ12 |
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| Residue: | 99 |
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| Sequence: | PQITLWQRPFVTIKIEGQLKEALLDTGADDTVLEEMNLPGRWKPKMIGGIGGFIKVRQYD
QIVIEICGKKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
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| BDBM50498813 |
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| n/a |
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| Name | BDBM50498813 |
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| Synonyms: | CHEMBL3627875 |
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| Type | Small organic molecule |
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| Emp. Form. | C35H45N3O8S |
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| Mol. Mass. | 667.812 |
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| SMILES | COC[C@@H]1C[C@H](O)CN1C(=O)c1cccc(c1)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)CN(CC(C)C)S(=O)(=O)c1ccc(OC)cc1 |r| |
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| Structure | 
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