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Target
DNA polymerase catalytic subunit
Ligand
BDBM222890
Substrate
n/a
Meas. Tech.
HCMV Polymerase LANCE TR-FRET Assay
pH
7.5±n/a
IC50
220±n/a nM
Comments
extracted
Citation
 Fader, L; Lepage, O; Bailey, M; Beaulieu, PL; Bilodeau, F; Carson, RJ; Giroux, A; Godbout, C; Moreau, B; Naud, J; Parisien, M; Poirier, M; Poirier, M; Surprenant, S; Thibeault, C Cytomegalovirus inhibitor compounds US Patent  US9315499 Publication Date 4/19/2016 
Target
Name:
DNA polymerase catalytic subunit
Synonyms:
DNA polymerase | DPOL_HCMVA | HFLF2 | Human herpesvirus 5 DNA polymerase | UL54
Type:
Protein
Mol. Mass.:
137111.39
Organism:
Human cytomegalovirus (HCMV strain AD169)
Description:
P08546
Residue:
1242
Sequence:
MFFNPYLSGGVTGGAVAGGRRQRSQPGSAQGSGKRPPQKQFLQIVPRGVMFDGQTGLIKHKTGRLPLMFYREIKHLLSHDMVWPCPWRETLVGRVVGPIRFHTYDQTDAVLFFDSPENVSPRYRQHLVPSGNVLRFFGATEHGYSICVNVFGQRSYFYCEYSDTDRLREVIASVGELVPEPRTPYAVSVTPATKTSIYGYGTRPVPDLQCVSISNWTMARKIGEYLLEQGFPVYEVRVDPLTRLVIDRRITTFGWCSVNRYDWRQQGRASTCDIEVDCDVSDLVAVPDDSSWPRYRCLSFDIECMSGEGGFPCAEKSDDIVIQISCVCYETGGNTAVDQGIPNGNDGRGCTSEGVIFGHSGLHLFTIGTCGQVGPDVDVYEFPSEYELLLGFMLFFQRYAPAFVTGYNINSFDLKYILTRLEYLYKVDSQRFCKLPTAQGGRFFLHSPAVGFKRQYAAAFPSASHNNPASTAATKVYIAGSVVIDMYPVCMAKTNSPNYKLNTMAELYLRQRKDDLSYKDIPRCFVANAEGRAQVGRYCLQDAVLVRDLFNTINFHYEAGAIARLAKIPLRRVIFDGQQIRIYTSLLDECACRDFILPNHYSKGTTVPETNSVAVSPNAAIISTAAVPGDAGSVAAMFQMSPPLQSAPSSQDGVSPGSGSNSSSSVGVFSVGSGSSGGVGVSNDNHGAGGTAAVSYQGATVFEPEVGYYNDPVAVFDFASLYPSIIMAHNLCYSTLLVPGGEYPVDPADVYSVTLENGVTHRFVRASVRVSVLSELLNKWVSQRRAVRECMRECQDPVRRMLLDKEQMALKVTCNAFYGFTGVVNGMMPCLPIAASITRIGRDMLERTARFIKDNFSEPCFLHNFFNQEDYVVGTREGDSEESSALPEGLETSSGGSNERRVEARVIYGDTDSVFVRFRGLTPQALVARGPSLAHYVTACLFVEPVKLEFEKVFVSLMMICKKRYIGKVEGASGLSMKGVDLVRKTACEFVKGVTRDVLSLLFEDREVSEAAVRLSRLSLDEVKKYGVPRGFWRILRRLVQARDDLYLHRVRVEDLVLSSVLSKDISLYRQSNLPHIAVIKRLAARSEELPSVGDRVFYVLTAPGVRTAPQGSSDNGDSVTAGVVSRSDAIDGTDDDADGGGVEESNRRGGEPAKKRARKPPSAVCNYEVAEDPSYVREHGVPIHADKYFEQVLKAVTNVLSPVFPGGETARKDKFLHMVLPRRLHLEPAFLPYSVKAHECC
  
Inhibitor
Name:
BDBM222890
Synonyms:
US9315499, 1008
Type:
Small organic molecule
Emp. Form.:
C23H23ClN4O4
Mol. Mass.:
454.906
SMILES:
CN(C1CC(O)C1)C(=O)Cn1c2ncccc2cc(C(=O)NCc2ccc(Cl)cc2)c1=O |(10.55,-6.15,;10.55,-7.69,;9.21,-8.46,;7.73,-8.06,;7.33,-9.55,;5.99,-10.32,;8.82,-9.95,;11.88,-8.46,;11.88,-10,;13.22,-7.69,;14.55,-8.46,;14.55,-10,;13.22,-10.77,;13.22,-12.31,;14.55,-13.08,;15.88,-12.31,;15.88,-10.77,;17.22,-10,;17.22,-8.46,;18.55,-7.69,;19.88,-8.46,;18.55,-6.15,;19.88,-5.38,;21.22,-6.15,;21.22,-7.69,;22.55,-8.46,;23.88,-7.69,;25.22,-8.46,;23.88,-6.15,;22.55,-5.38,;15.88,-7.69,;15.88,-6.15,)|
Structure:
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