Reaction Details Report a problem with these data
Target
Integrase
Ligand
BDBM50055710
Substrate
n/a
Meas. Tech.
ChEMBL_88614 (CHEMBL701718)
IC50
>100000±n/a nM
Citation
 Zhao, H; Neamati, N; Hong, H; Mazumder, A; Wang, S; Sunder, S; Milne, GW; Pommier, Y; Burke, TR Coumarin-based inhibitors of HIV integrase. J Med Chem 40:242-9 (1997) [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:
BDBM50055710
Synonyms:
4-HYDROXY-2H-CHROMEN-2-ONE | 4-Hydroxy-chromen-2-one | 4-hydroxycoumarin | CHEMBL301141
Type:
Small organic molecule
Emp. Form.:
C9H6O3
Mol. Mass.:
162.1421
SMILES:
Oc1cc(=O)oc2ccccc12
Structure:
Search PDB for entries with ligand similarity: