| Reaction Details |
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 | Report a problem with these data |
| Target | Integrase |
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| Ligand | BDBM50141234 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_90870 (CHEMBL699303) |
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| IC50 | 70±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 |
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| Synonyms: | Human immunodeficiency virus type 1 integrase |
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| Type: | PROTEIN |
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| Mol. Mass.: | 32231.48 |
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| Organism: | Human immunodeficiency virus 1 |
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| Description: | ChEMBL_90865 |
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| Residue: | 288 |
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| Sequence: | FLDGIDKAQDEHEKYHSNWRAMASDFNLPPVVAKEIVASCDKCQLKGEAMHGQVDCSPGI
WQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTIHTDNGSN
FTSTTVKAACWWAGIKQEFGIPYNPQSQGVVESMNKELKKIIGQVRDQAEHLKTAVQMAV
FIHNFKRKGGIGGYSAGERIVDIIATDIQTKELQKQITKIQNFRVYYRDSRDPLWKGPAK
LLWKGEGAVVIQDNSDIKVVPRRKVKIIRDYGKQMAGDDCVASRQDED
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| BDBM50141234 |
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| n/a |
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| Name | BDBM50141234 |
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| Synonyms: | CHEMBL409132 | N,N'-Bis-(4-{4-[4-(3-dimethylamino-propylcarbamoyl)-3-methyl-cyclopenta-1,4-dienylcarbamoyl]-3-methyl-cyclopenta-1,4-dienylcarbamoyl}-3-methyl-cyclopenta-1,4-dienyl)-N,N'-dimethyl-terephthalamide |
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| Type | Small organic molecule |
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| Emp. Form. | C62H76N10O8 |
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| Mol. Mass. | 1089.329 |
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| SMILES | CC1C=C(NC(=O)C2=CC(NC(=O)C3=CC(=CC3C)N(C)C(=O)c3ccc(cc3)C(=O)N(C)C3=CC(C)C(=C3)C(=O)NC3=CC(C)C(=C3)C(=O)NC3=CC(C)C(=C3)C(=O)NCCCN(C)C)=CC2C)C=C1C(=O)NCCCN(C)C |c:15,39,49,59,70,75,t:2,7,13,35,45,55| |
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| Structure | 
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