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Target
Integrase
Ligand
BDBM50483875
Substrate
n/a
Meas. Tech.
ChEMBL_746336 (CHEMBL1777555)
IC50
14±n/a nM
Citation
 Johnson, TW; Tanis, SP; Butler, SL; Dalvie, D; Delisle, DM; Dress, KR; Flahive, EJ; Hu, Q; Kuehler, JE; Kuki, A; Liu, W; McClellan, GA; Peng, Q; Plewe, MB; Richardson, PF; Smith, GL; Solowiej, J; Tran, KT; Wang, H; Yu, X; Zhang, J; Zhu, H Design and synthesis of novel N-hydroxy-dihydronaphthyridinones as potent and orally bioavailable HIV-1 integrase inhibitors. J Med Chem 54:3393-417 (2011) [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:
BDBM50483875
Synonyms:
CHEMBL1773403
Type:
Small organic molecule
Emp. Form.:
C26H25FN4O3
Mol. Mass.:
460.5001
SMILES:
ON1CCc2c(ncc3n(Cc4ccc(F)cc4)cc(COCCCc4ccccn4)c23)C1=O
Structure:
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