Reaction Details |
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Target | Integrase |
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Ligand | BDBM50483778 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_744494 (CHEMBL1772515) |
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IC50 | >300000±n/a nM |
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Citation | Vandurm, P; Guiguen, A; Cauvin, C; Georges, B; Le Van, K; Michaux, C; Cardona, C; Mbemba, G; Mouscadet, JF; Hevesi, L; Van Lint, C; Wouters, J Synthesis, biological evaluation and molecular modeling studies of quinolonyl diketo acid derivatives: new structural insight into the HIV-1 integrase inhibition. Eur J Med Chem46:1749-56 (2011) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Integrase |
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Name: | Integrase |
Synonyms: | pol |
Type: | PROTEIN |
Mol. Mass.: | 32203.43 |
Organism: | Human immunodeficiency virus 1 |
Description: | ChEMBL_106649 |
Residue: | 288 |
Sequence: | FLDGIDKAQEEHEKYHSNWRAMASDFNLPPVVAKEIVASCDKCQLKGEAMHGQVDCSPGI
WQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSN
FTSTTVKAACWWAGIKQEFGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAV
FIHNFKRKGGIGGYSAGERIVDIIATDIQTKELQKQITKIQNFRVYYRDSRDPVWKGPAK
LLWKGEGAVVIQDNSDIKVVPRRKAKIIRDYGKQMAGDDCVASRQDED
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BDBM50483778 |
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n/a |
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Name | BDBM50483778 |
Synonyms: | CHEMBL1770427 |
Type | Small organic molecule |
Emp. Form. | C29H23F2NO6 |
Mol. Mass. | 519.4928 |
SMILES | CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(F)cc2)c2ccc(OCc3ccc(F)cc3)cc2c1=O |
Structure |
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