Reaction Details |
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Target | Gag-Pol polyprotein [1148-1435] |
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Ligand | BDBM50056898 |
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Substrate/Competitor | n/a |
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Meas. Tech. | HIV-1 Integrase Assay |
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IC50 | 7e+2±n/a nM |
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Citation | Bhatt, H; Patel, P; Pannecouque, C Discovery of HIV-1 integrase inhibitors: pharmacophore mapping, virtual screening, molecular docking, synthesis, and biological evaluation. Chem Biol Drug Des83:154-66 (2014) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Gag-Pol polyprotein [1148-1435] |
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Name: | Gag-Pol polyprotein [1148-1435] |
Synonyms: | HIV-1 Integrase | POL_HV1H2 | gag-pol |
Type: | Enzyme |
Mol. Mass.: | 32171.42 |
Organism: | Human immunodeficiency virus type 1 |
Description: | The sequence encoding the 288-amino-acid wild-type full-length integrase was cloned with an N-terminal 6His tag, and expressed in E. coli. |
Residue: | 288 |
Sequence: | FLDGIDKAQDEHEKYHSNWRAMASDFNLPPVVAKEIVASCDKCQLKGEAMHGQVDCSPGI
WQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTIHTDNGSN
FTGATVRAACWWAGIKQEFGIPYNPQSQGVVESMNKELKKIIGQVRDQAEHLKTAVQMAV
FIHNFKRKGGIGGYSAGERIVDIIATDIQTKELQKQITKIQNFRVYYRDSRNPLWKGPAK
LLWKGEGAVVIQDNSDIKVVPRRKAKIIRDYGKQMAGDDCVASRQDED
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BDBM50056898 |
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n/a |
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Name | BDBM50056898 |
Synonyms: | 2-Hydroxy-benzoic acid N'-(2-hydroxy-benzyl)-hydrazide | 2-hydroxy-N'-[(2- hydroxyphenyl)methyl]benzohydrazide (Compound 4) | CHEMBL433983 |
Type | Small organic molecule |
Emp. Form. | C14H14N2O3 |
Mol. Mass. | 258.2726 |
SMILES | Oc1ccccc1CNNC(=O)c1ccccc1O |
Structure |
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