Reaction Details Report a problem with these data
Target
Integrase
Ligand
BDBM50066314
Substrate
n/a
Meas. Tech.
ChEMBL_88599 (CHEMBL701178)
IC50
600±n/a nM
Citation
 Neamati, N; Hong, H; Owen, JM; Sunder, S; Winslow, HE; Christensen, JL; Zhao, H; Burke, TR; Milne, GW; Pommier, Y Salicylhydrazine-containing inhibitors of HIV-1 integrase: implication for a selective chelation in the integrase active site. J Med Chem 41:3202-9 (1998) [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:
BDBM50066314
Synonyms:
2-(2-Hydroxy-benzoyl)-4-[1-(4-hydroxy-phenyl)-meth-(E)-ylidene]-5-methyl-2,4-dihydro-pyrazol-3-one | CHEMBL109077
Type:
Small organic molecule
Emp. Form.:
C18H14N2O4
Mol. Mass.:
322.3148
SMILES:
Oc1ccc(C=c2c(=C)[nH]n(C(=O)c3ccccc3O)c2=O)cc1 |w:5.4|
Structure:
Search PDB for entries with ligand similarity: