Target
Integrase
Ligand
BDBM50083953
Substrate
n/a
Meas. Tech.
ChEMBL_88608 (CHEMBL873101)
IC50
>100000±n/a nM
Citation
 Pais, GCZhang, XMarchand, CNeamati, NCowansage, KSvarovskaia, ESPathak, VKTang, YNicklaus, MPommier, YBurke, TR Structure activity of 3-aryl-1,3-diketo-containing compounds as HIV-1 integrase inhibitors. J Med Chem 45:3184-94 (2002) [PubMed]  Article 
Target
Name:
Integrase
Synonyms:
Human immunodeficiency virus type 1 integrase
Type:
PROTEIN
Mol. Mass.:
32231.48
Organism:
Human immunodeficiency virus 1
Description:
ChEMBL_90865
Residue:
288
Sequence:
FLDGIDKAQDEHEKYHSNWRAMASDFNLPPVVAKEIVASCDKCQLKGEAMHGQVDCSPGIWQLDCTHLEGKVILVAVHVASGYIEAEVIPAETGQETAYFLLKLAGRWPVKTIHTDNGSNFTSTTVKAACWWAGIKQEFGIPYNPQSQGVVESMNKELKKIIGQVRDQAEHLKTAVQMAVFIHNFKRKGGIGGYSAGERIVDIIATDIQTKELQKQITKIQNFRVYYRDSRDPLWKGPAKLLWKGEGAVVIQDNSDIKVVPRRKVKIIRDYGKQMAGDDCVASRQDED
  
Inhibitor
Name:
BDBM50083953
Synonyms:
(Z)-4-(3-Bromo-phenyl)-2-hydroxy-4-oxo-but-2-enoic acid | 4-(3-Bromo-phenyl)-2-hydroxy-4-oxo-but-2-enoic acid | 4-(3-Bromo-phenyl)-2-hydroxy-4-oxo-but-2-enoic acid (0.35H2O) | CHEMBL22197 | Sacchettini_7
Type:
Small organic molecule
Emp. Form.:
C10H7BrO4
Mol. Mass.:
271.064
SMILES:
OC(=O)C(=O)CC(=O)c1cccc(Br)c1
Structure:
Search PDB for entries with ligand similarity: