Reaction Details |
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Target | Integrase |
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Ligand | BDBM50492497 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_969976 (CHEMBL2405242) |
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IC50 | 5.0±n/a nM |
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Citation | Johns, BA; Kawasuji, T; Weatherhead, JG; Taishi, T; Temelkoff, DP; Yoshida, H; Akiyama, T; Taoda, Y; Murai, H; Kiyama, R; Fuji, M; Tanimoto, N; Jeffrey, J; Foster, SA; Yoshinaga, T; Seki, T; Kobayashi, M; Sato, A; Johnson, MN; Garvey, EP; Fujiwara, T Carbamoyl pyridone HIV-1 integrase inhibitors 3. A diastereomeric approach to chiral nonracemic tricyclic ring systems and the discovery of dolutegravir (S/GSK1349572) and (S/GSK1265744). J Med Chem56:5901-16 (2013) [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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BDBM50492497 |
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n/a |
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Name | BDBM50492497 |
Synonyms: | CHEMBL2403118 |
Type | Small organic molecule |
Emp. Form. | C20H20FN3O5 |
Mol. Mass. | 401.3883 |
SMILES | [H][C@]12Cn3cc(C(=O)NCc4ccc(F)cc4)c(=O)c(O)c3C(=O)N1CC[C@@H](C)O2 |r| |
Structure |
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