Reaction Details |
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Target | Integrase |
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Ligand | BDBM50141238 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_90870 (CHEMBL699303) |
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IC50 | 970±n/a nM |
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Citation | Mustata, GI; Brigo, A; Briggs, JM HIV-1 integrase pharmacophore model derived from diverse classes of inhibitors. Bioorg Med Chem Lett14:1447-54 (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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BDBM50141238 |
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n/a |
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Name | BDBM50141238 |
Synonyms: | CHEMBL3138501 |
Type | Small organic molecule |
Emp. Form. | C51H58O14 |
Mol. Mass. | 894.9978 |
SMILES | [H][C@@]12CCC(C(C)CCC(O)=O)[C@@]1(C)C(C[C@@]1([H])[C@@]2([H])C(CC2CC(CC[C@]12C)OC(=O)\C=C\c1ccc(O)c(O)c1)OC(=O)\C=C\c1ccc(O)c(O)c1)OC(=O)\C=C\c1ccc(O)c(O)c1 |r| |
Structure |
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