Reaction Details Report a problem with these data
Target
Integrase
Ligand
BDBM50480408
Substrate
n/a
Meas. Tech.
ChEMBL_644449 (CHEMBL1211287)
IC50
69±n/a nM
Citation
 Lu, P; Wei, X; Zhang, R CoMFA and CoMSIA 3D-QSAR studies on quionolone caroxylic acid derivatives inhibitors of HIV-1 integrase. Eur J Med Chem 45:3413-9 (2010) [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:
BDBM50480408
Synonyms:
CHEMBL560234
Type:
Small organic molecule
Emp. Form.:
C17H11Cl2NO3
Mol. Mass.:
348.18
SMILES:
OC(=O)c1c[nH]c2ccc(Cc3cccc(Cl)c3Cl)cc2c1=O
Structure:
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