Reaction Details  Report a problem with these data
Target
Integrase
Ligand
BDBM50479828
Substrate
n/a
Meas. Tech.
ChEMBL_542592 (CHEMBL1014188)
IC50
900±n/a nM
Citation
 Sechi, M; Rizzi, G; Bacchi, A; Carcelli, M; Rogolino, D; Pala, N; Sanchez, TW; Taheri, L; Dayam, R; Neamati, N Design and synthesis of novel dihydroquinoline-3-carboxylic acids as HIV-1 integrase inhibitors. Bioorg Med Chem 17:2925-35 (2009) [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:
BDBM50479828
Synonyms:
CHEMBL464215
Type:
Small organic molecule
Emp. Form.:
C18H14FNO4
Mol. Mass.:
327.3065
SMILES:
Cn1c2ccc(Cc3ccc(F)cc3)cc2c(O)c(C(O)=O)c1=O
Structure:
Search PDB for entries with ligand similarity: