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TargetIntegrase
LigandBDBM50489259
Substrate/Competitorn/a
Meas. Tech.ChEMBL_934758 (CHEMBL2318645)
IC50 5.0±n/a nM
Citation Johns, BAKawasuji, TWeatherhead, JGBoros, EEThompson, JBKoble, CSGarvey, EPFoster, SAJeffrey, JLFujiwara, T Naphthyridinone (NTD) integrase inhibitors: N1 protio and methyl combination substituent effects with C3 amide groups. Bioorg Med Chem Lett23:422-5 (2013) [PubMed]  Article
More Info.:Get all data from this article,  Assay Method
 
Integrase
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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  Blast E-value cutoff:
BDBM50489259
n/a
NameBDBM50489259
Synonyms:CHEMBL2315832
TypeSmall organic molecule
Emp. Form.C21H23FN4O5S
Mol. Mass.462.495
SMILESCN(CCNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(C)c1=O)S(C)(=O)=O
Structure
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