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Target
Integrase
Ligand
BDBM50169885
Substrate
n/a
Meas. Tech.
ChEMBL_305236 (CHEMBL832484)
IC50
700000±n/a nM
Citation
 Meadows, DC; Mathews, TB; North, TW; Hadd, MJ; Kuo, CL; Neamati, N; Gervay-Hague, J Synthesis and biological evaluation of geminal disulfones as HIV-1 integrase inhibitors. J Med Chem 48:4526-34 (2005) [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:
BDBM50169885
Synonyms:
1,2-di(benzyloxy)-4-[2-[2-[3,4-di(benzyloxy)phenyl]-(E)-1-ethenylsulfonylmethylsulfonyl]-(E)-1-ethenyl]benzene | CHEMBL373310 | bis(1,2-benzyloxy-trans-5-(2-ethanesulfonyl-vinyl)-benzene)
Type:
Small organic molecule
Emp. Form.:
C45H40O8S2
Mol. Mass.:
772.924
SMILES:
O=S(=O)(CS(=O)(=O)\C=C\c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1)\C=C\c1ccc(OCc2ccccc2)c(OCc2ccccc2)c1
Structure:
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