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TargetIntegrase
LigandBDBM50485899
Substrate/Competitorn/a
Meas. Tech.ChEMBL_878295 (CHEMBL2185500)
IC50>100000±n/a nM
Citation Zeng, LFWang, YKazemi, RXu, SXu, ZLSanchez, TWYang, LMDebnath, BOdde, SXie, HZheng, YTDing, JNeamati, NLong, YQ Repositioning HIV-1 integrase inhibitors for cancer therapeutics: 1,6-naphthyridine-7-carboxamide as a promising scaffold with drug-like properties. J Med Chem55:9492-509 (2012) [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
Blast this sequence in BindingDB or PDB
  Blast E-value cutoff:
BDBM50485899
n/a
NameBDBM50485899
Synonyms:CHEMBL2180572
TypeSmall organic molecule
Emp. Form.C18H17BrFN5O
Mol. Mass.418.263
SMILESNCCNc1c(nc(Br)c2cccnc12)C(=O)NCc1ccc(F)cc1
Structure
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