Reaction Details Report a problem with these data
Target
Integrase
Ligand
BDBM50479114
Substrate
n/a
Meas. Tech.
ChEMBL_514887 (CHEMBL972695)
IC50
>100000±n/a nM
Citation
 Zeng, LF; Zhang, HS; Wang, YH; Sanchez, T; Zheng, YT; Neamati, N; Long, YQ Efficient synthesis and utilization of phenyl-substituted heteroaromatic carboxylic acids as aryl diketo acid isosteres in the design of novel HIV-1 integrase inhibitors. Bioorg Med Chem Lett 18:4521-4 (2008) [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:
BDBM50479114
Synonyms:
CHEMBL450074
Type:
Small organic molecule
Emp. Form.:
C10H6N2O5
Mol. Mass.:
234.165
SMILES:
OC(=O)c1cc(on1)-c1ccc(cc1)[N+]([O-])=O
Structure:
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