| Reaction Details |
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 | Report a problem with these data |
| Target | Protease |
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| Ligand | BDBM50180655 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_858806 (CHEMBL2167500) |
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| Ki | 0.005000±n/a nM |
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| Citation |  Huggins, DJ; Sherman, W; Tidor, B Rational approaches to improving selectivity in drug design. J Med Chem55:1424-44 (2012) [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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| BDBM50180655 |
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| n/a |
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| Name | BDBM50180655 |
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| Synonyms: | A-157378-0 | A-157378.0 | ABT-378 | CHEBI:31781 | Kaletra | Lopinavir | med.21724, Compound 185 |
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| Type | Small organic molecule |
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| Emp. Form. | C37H48N4O5 |
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| Mol. Mass. | 628.8008 |
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| SMILES | CC(C)[C@H](N1CCCNC1=O)C(=O)N[C@H](C[C@H](O)[C@H](Cc1ccccc1)NC(=O)COc1c(C)cccc1C)Cc1ccccc1 |
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| Structure | 
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