Reaction Details |
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Target | Gag-Pol polyprotein [489-587] |
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Ligand | BDBM50422331 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_158034 (CHEMBL768258) |
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IC50 | 9.5±n/a nM |
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Citation | Jayatilleke, PR; Nair, AC; Zauhar, R; Welsh, WJ Computational studies on HIV-1 protease inhibitors: influence of calculated inhibitor-enzyme binding affinities on the statistical quality of 3D-QSAR CoMFA models. J Med Chem43:4446-51 (2000) [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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BDBM50422331 |
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n/a |
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Name | BDBM50422331 |
Synonyms: | CHEMBL138336 |
Type | Small organic molecule |
Emp. Form. | C29H38N2O5 |
Mol. Mass. | 494.6224 |
SMILES | CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)[C@@H](O)C[C@@H](Cc1ccccc1)C(=O)NC1C=CC[C@@H]1O |c:33| |
Structure |
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