Reaction Details Report a problem with these data
Target
Integrase
Ligand
BDBM50477777
Substrate
n/a
Meas. Tech.
ChEMBL_458636 (CHEMBL941965)
IC50
68000±n/a nM
Citation
 Al-Mawsawi, LQ; Dayam, R; Taheri, L; Witvrouw, M; Debyser, Z; Neamati, N Discovery of novel non-cytotoxic salicylhydrazide containing HIV-1 integrase inhibitors. Bioorg Med Chem Lett 17:6472-5 (2007) [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:
BDBM50477777
Synonyms:
CHEMBL398558
Type:
Small organic molecule
Emp. Form.:
C16H14N6O4S
Mol. Mass.:
386.385
SMILES:
Oc1ccc(C(=O)NNC(=O)CSc2nnnn2-c2ccccc2)c(O)c1
Structure:
Search PDB for entries with ligand similarity: