| Reaction Details |
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 | Report a problem with these data |
| Target | Gag-Pol polyprotein [489-587] |
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| Ligand | BDBM50005695 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_158033 (CHEMBL768257) |
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| IC50 | 1.9±n/a nM |
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| Citation |  Waller, CL; Oprea, TI; Giolitti, A; Marshall, GR Three-dimensional QSAR of human immunodeficiency virus (I) protease inhibitors. 1. A CoMFA study employing experimentally-determined alignment rules. J Med Chem36:4152-60 (1994) [PubMed] |
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| More Info.: | Get all data from this article, Assay Method |
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| |
| Gag-Pol polyprotein [489-587] |
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| Name: | Gag-Pol polyprotein [489-587] |
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| Synonyms: | Human immunodeficiency virus type 1 protease | POL_HV1H2 | Pol polyprotein | gag-pol |
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| Type: | Enzyme Subunit |
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| Mol. Mass.: | 10781.16 |
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| Organism: | Human immunodeficiency virus type 1 |
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| Description: | P04585[489-587] |
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| Residue: | 99 |
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| Sequence: | PQVTLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYD
QILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
|
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|
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| BDBM50005695 |
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| n/a |
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| Name | BDBM50005695 |
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| Synonyms: | 1-(2-Hydroxy-3-{3-methyl-2-[2-(naphthalen-1-yloxy)-acetylamino]-butyrylamino}-4-phenyl-butyryl)-pyrrolidine-2-carboxylic acid tert-butylamide | BDBM50407028 | CHEMBL335391 |
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| Type | Small organic molecule |
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| Emp. Form. | C36H46N4O6 |
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| Mol. Mass. | 630.7736 |
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| SMILES | CC(C)[C@H](NC(=O)COc1cccc2ccccc12)C(=O)N[C@@H](Cc1ccccc1)[C@H](O)C(=O)N1CCC[C@H]1C(=O)NC(C)(C)C |
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| Structure | 
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