| Reaction Details |
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 | Report a problem with these data |
| Target | Protease |
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| Ligand | BDBM50127975 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_457204 (CHEMBL940805) |
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| IC50 | 0.030000±n/a nM |
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| Citation |  Raghavan, S; Lu, Z; Beeson, T; Chapman, KT; Schleif, WA; Olsen, DB; Stahlhut, M; Rutkowski, CA; Gabryelski, L; Emini, E; Tata, JR Synthesis of novel HIV protease inhibitors (PI) with activity against PI-resistant virus. Bioorg Med Chem Lett17:5432-6 (2007) [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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| BDBM50127975 |
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| n/a |
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| Name | BDBM50127975 |
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| Synonyms: | (R)-3-[(2S,4R)-2-Hydroxy-4-((3S,4S)-3-hydroxy-chroman-4-ylcarbamoyl)-5-phenyl-pentanoyl]-5,5-dimethyl-thiazolidine-4-carboxylic acid 2,6-dimethyl-benzylamide | (R)-N-(2,6-dimethylbenzyl)-3-((2S,4R)-4-benzyl-2-hydroxy-5-((3S,4S)-3-hydroxychroman-4-ylamino)-5-oxopentanoyl)-5,5-dimethylthiazolidine-4-carboxamide | CHEMBL298393 |
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| Type | Small organic molecule |
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| Emp. Form. | C36H43N3O6S |
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| Mol. Mass. | 645.808 |
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| SMILES | Cc1cccc(C)c1CNC(=O)[C@H]1N(CSC1(C)C)C(=O)[C@@H](O)C[C@@H](Cc1ccccc1)C(=O)N[C@@H]1[C@H](O)COc2ccccc12 |
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| Structure | 
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