Target
Integrase
Ligand
BDBM50489299
Substrate
n/a
Meas. Tech.
ChEMBL_934758 (CHEMBL2318645)
IC50
2.0±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 Lett 23:422-5 (2013) [PubMed]  Article 
Target
Name:
Integrase
Synonyms:
pol
Type:
PROTEIN
Mol. Mass.:
32203.43
Organism:
Human immunodeficiency virus 1
Description:
ChEMBL_106649
Residue:
288
Sequence:
FLDGIDKAQEEHEKYHSNWRAMASDFNLPPVVAKEIVASCDKCQLKGEAMHGQVDCSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTVHTDNGSNFTSTTVKAACWWAGIKQEFGIPYNPQSQGVIESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNFKRKGGIGGYSAGERIVDIIATDIQTKELQKQITKIQNFRVYYRDSRDPVWKGPAKLLWKGEGAVVIQDNSDIKVVPRRKAKIIRDYGKQMAGDDCVASRQDED
  
Inhibitor
Name:
BDBM50489299
Synonyms:
CHEMBL2316125
Type:
Small organic molecule
Emp. Form.:
C20H20FN3O4
Mol. Mass.:
385.3889
SMILES:
C[C@H](O)CNC(=O)c1c(O)c2ncc(Cc3ccc(F)cc3)cc2n(C)c1=O |r|
Structure:
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