Reaction Details Report a problem with these data
Target
Tripartite terminase subunit 3
Ligand
BDBM50604825
Substrate
n/a
Meas. Tech.
ChEMBL_2249483 (CHEMBL5163693)
IC50
5700±n/a nM
Citation
 He, T; Edwards, TC; Xie, J; Aihara, H; Geraghty, RJ; Wang, Z 4,5-Dihydroxypyrimidine Methyl Carboxylates, Carboxylic Acids, and Carboxamides as Inhibitors of Human Cytomegalovirus pUL89 Endonuclease. J Med Chem 65:5830-5849 (2022) [PubMed] 
Target
Name:
Tripartite terminase subunit 3
Synonyms:
3.1.-.- | TRM3 | TRM3_HCMVA | Terminase large subunit | Tripartite terminase subunit 3
Type:
PROTEIN
Mol. Mass.:
77099.22
Organism:
Human cytomegalovirus (strain AD169) (HHV-5) (Human herpesvirus 5)
Description:
ChEMBL_120506
Residue:
674
Sequence:
MLRGDSAAKIQERYAELQKRKSHPTSCISTAFTNVATLCRKRYQMMHPELGLAHSCNEAFLPLMAFCGRHRDYNSPEESQRELLFHERLKSALDKLTFRPCSEEQRASYQKLDALTELYRDPQFQQINNFMTDFKKWLDGGFSTAVEGDAKAIRLEPFQKNLLIHVIFFIAVTKIPVLANRVLQYLIHAFQIDFLSQTSIDIFKQKATVFLVPRRHGKTWFIIPIISFLLKHMIGISIGYVAHQKHVSQFVLKEVEFRCRHTFARDYVVENKDNVISIDHRGAKSTALFASCYNTNSIRGQNFHLLLVDEAHFIKKEAFNTILGFLAQNTTKIIFISSTNTTSDSTCFLTRLNNAPFDMLNVVSYVCEEHLHSFTEKGDATACPCYRLHKPTFISLNSQVRKTANMFMPGAFMDEIIGGTNKISQNTVLITDQSREEFDILRYSTLNTNAYDYFGKTLYVYLDPAFTTNRKASGTGVAAVGAYRHQFLIYGLEHFFLRDLSESSEVAIAECAAHMIISVLSLHPYLDELRIAVEGNTNQAAAVRIACLIRQSVQSSTLIRVLFYHTPDQNHIEQPFYLMGRDKALAVEQFISRFNSGYIKASQELVSYTIKLSHDPIEYLLEQIQNLHRVTLAEGTTARYSAKRQNRISDDLIIAVIMATYLCDDIHAIRFRVS
  
Inhibitor
Name:
BDBM50604825
Synonyms:
CHEMBL5184235
Type:
Small organic molecule
Emp. Form.:
C13H10Cl2N2O4
Mol. Mass.:
329.136
SMILES:
COC(=O)c1nc(Cc2ccc(Cl)cc2Cl)[nH]c(=O)c1O
Structure:
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