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Target
Integrase
Ligand
BDBM50480788
Substrate
n/a
Meas. Tech.
ChEMBL_585784 (CHEMBL1060098)
IC50
20±n/a nM
Citation
 Nizi, E; Orsale, MV; Crescenzi, B; Pescatore, G; Muraglia, E; Alfieri, A; Gardelli, C; Spieser, SA; Summa, V Dihydroxy-pyrimidine and N-methylpyrimidone HIV-integrase inhibitors: improving cell based activity by the quaternarization of a chiral center. Bioorg Med Chem Lett 19:4617-21 (2009) [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:
BDBM50480788
Synonyms:
CHEMBL550202
Type:
Small organic molecule
Emp. Form.:
C24H26FN5O4S
Mol. Mass.:
499.558
SMILES:
Cc1nc(C)c(s1)C(=O)N1CCCCC1(C)c1nc(C(=O)NCc2ccc(F)cc2)c(O)c(=O)[nH]1
Structure:
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