Reaction Details |
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Target | Gag-Pol polyprotein [489-587] |
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Ligand | BDBM1102 |
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Substrate/Competitor | n/a |
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Meas. Tech. | Protease Inhibition Assay |
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Ki | 0.15±n/a nM |
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Citation | De Lucca, GV; Liang, J; De Lucca, I Stereospecific synthesis, structure-activity relationship, and oral bioavailability of tetrahydropyrimidin-2-one HIV protease inhibitors. J Med Chem42:135-52 (1999) [PubMed] Article |
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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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BDBM1102 |
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n/a |
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Name | BDBM1102 |
Synonyms: | (4R,5R,6R)-Tetrahydro-1,3-bis[(3-carboxamidophenyl)methyl]-5-hydroxy-4-(2-(3,4-difluorophenyl)ethyl)-6-(3,4-difluorophenylmethyl)-2(1H)-pyrimidinone | 3-{[(4R,5R,6R)-3-[(3-carbamoylphenyl)methyl]-6-[2-(3,4-difluorophenyl)ethyl]-4-[(3,4-difluorophenyl)methyl]-5-hydroxy-2-oxo-1,3-diazinan-1-yl]methyl}benzamide | Tetrahydropyrimidinone deriv. 58 |
Type | Small organic molecule |
Emp. Form. | C35H32F4N4O4 |
Mol. Mass. | 648.6466 |
SMILES | NC(=O)c1cccc(CN2[C@H](CCc3ccc(F)c(F)c3)[C@@H](O)[C@@H](Cc3ccc(F)c(F)c3)N(Cc3cccc(c3)C(N)=O)C2=O)c1 |r| |
Structure |
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