Reaction Details |
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Target | Integrase |
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Ligand | BDBM50409838 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_88770 (CHEMBL701802) |
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IC50 | 6025.6±n/a nM |
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Citation | Kuo, CL; Assefa, H; Kamath, S; Brzozowski, Z; Slawinski, J; Saczewski, F; Buolamwini, JK; Neamati, N Application of CoMFA and CoMSIA 3D-QSAR and docking studies in optimization of mercaptobenzenesulfonamides as HIV-1 integrase inhibitors. J Med Chem47:385-99 (2004) [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: | Human immunodeficiency virus type 1 integrase |
Type: | PROTEIN |
Mol. Mass.: | 32231.48 |
Organism: | Human immunodeficiency virus 1 |
Description: | ChEMBL_90865 |
Residue: | 288 |
Sequence: | FLDGIDKAQDEHEKYHSNWRAMASDFNLPPVVAKEIVASCDKCQLKGEAMHGQVDCSPGI
WQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTIHTDNGSN
FTSTTVKAACWWAGIKQEFGIPYNPQSQGVVESMNKELKKIIGQVRDQAEHLKTAVQMAV
FIHNFKRKGGIGGYSAGERIVDIIATDIQTKELQKQITKIQNFRVYYRDSRDPLWKGPAK
LLWKGEGAVVIQDNSDIKVVPRRKVKIIRDYGKQMAGDDCVASRQDED
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BDBM50409838 |
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n/a |
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Name | BDBM50409838 |
Synonyms: | CHEMBL127330 |
Type | Small organic molecule |
Emp. Form. | C21H15Cl2N5O3S2 |
Mol. Mass. | 520.411 |
SMILES | Sc1cc(Cl)c(cc1S(=O)(=O)Nc1nncn1-c1ccc(Cl)cc1)C(=O)Nc1ccccc1 |
Structure |
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