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Target
Integrase
Ligand
BDBM50482545
Substrate
n/a
Meas. Tech.
ChEMBL_647171 (CHEMBL1217312)
IC50
5050±n/a nM
Citation
 Ferro, S; De Luca, L; Barreca, ML; De Grazia, S; Christ, F; Debyser, Z; Chimirri, A New chloro,fluorobenzylindole derivatives as integrase strand-transfer inhibitors (INSTIs) and their mode of action. Bioorg Med Chem 18:5510-8 (2010) [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:
BDBM50482545
Synonyms:
CHEMBL1214586
Type:
Small organic molecule
Emp. Form.:
C22H19ClFNO5
Mol. Mass.:
431.841
SMILES:
CCOC(=O)C(\O)=C\C(=O)c1cn(Cc2ccc(Cl)c(F)c2)c2cccc(OC)c12
Structure:
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