Reaction Details |
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Target | Gag-Pol polyprotein [489-587] |
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Ligand | BDBM50422054 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_158031 (CHEMBL768622) |
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IC50 | 1269±n/a nM |
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Citation | Holloway, MK; Wai, JM; Halgren, TA; Fitzgerald, PM; Vacca, JP; Dorsey, BD; Levin, RB; Thompson, WJ; Chen, LJ; deSolms, SJ A priori prediction of activity for HIV-1 protease inhibitors employing energy minimization in the active site. J Med Chem38:305-17 (1995) [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] |
Synonyms: | Human immunodeficiency virus type 1 protease | POL_HV1H2 | Pol polyprotein | gag-pol |
Type: | Enzyme Subunit |
Mol. Mass.: | 10781.16 |
Organism: | Human immunodeficiency virus type 1 |
Description: | P04585[489-587] |
Residue: | 99 |
Sequence: | PQVTLWQRPLVTIKIGGQLKEALLDTGADDTVLEEMSLPGRWKPKMIGGIGGFIKVRQYD
QILIEICGHKAIGTVLVGPTPVNIIGRNLLTQIGCTLNF
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BDBM50422054 |
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n/a |
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Name | BDBM50422054 |
Synonyms: | CHEMBL111175 |
Type | Small organic molecule |
Emp. Form. | C36H44N2O5 |
Mol. Mass. | 584.745 |
SMILES | CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C[C@]1(Cc2ccccc2)CCCN([C@@H]2[C@H](O)Cc3ccccc23)C1=O |r| |
Structure |
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