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Target
Envelope phospholipase F13
Ligand
BDBM50577047
Substrate
n/a
Meas. Tech.
ChEMBL_2128845 (CHEMBL4838274)
IC50
3060±n/a nM
Citation
 Shiryaev, VA; Skomorohov, MY; Leonova, MV; Bormotov, NI; Serova, OA; Shishkina, LN; Agafonov, AP; Maksyutov, RA; Klimochkin, YN Adamantane derivatives as potential inhibitors of p37 major envelope protein and poxvirus reproduction. Design, synthesis and antiviral activity. Eur J Med Chem 221:0 (2021) [PubMed]  Article 
Target
Name:
Envelope phospholipase F13
Synonyms:
3.1.1.- | 37 kDa protein | Envelope phospholipase F13 | OPG057 | PG057_VACCW | Palmitoylated EV membrane protein | p37K
Type:
PROTEIN
Mol. Mass.:
41798.24
Organism:
Vaccinia virus (strain Western Reserve) (VACV) (Vaccinia virus (strainWR))
Description:
ChEMBL_118391
Residue:
372
Sequence:
MWPFASVPAGAKCRLVETLPENMDFRSDHLTTFECFNEIITLAKKYIYIASFCCNPLSTTRGALIFDKLKEASEKGIKIIVLLDERGKRNLGELQSHCPDINFITVNIDKKNNVGLLLGCFWVSDDERCYVGNASFTGGSIHTIKTLGVYSDYPPLATDLRRRFDTFKAFNSAKNSWLNLCSAACCLPVSTAYHIKNPIGGVFFTDSPEHLLGYSRDLDTDVVIDKLKSAKTSIDIEHLAIVPTTRVDGNSYYWPDIYNSIIEAAINRGVKIRLLVGNWDKNDVYSMATARSLDALCVQNDLSVKVFTIQNNTKLLIVDDEYVHITSANFDGTHYQNHGFVSFNSIDKQLVSEAKKIFERDWVSSHSKSLKI
  
Inhibitor
Name:
BDBM50577047
Synonyms:
CHEMBL4865942
Type:
Small organic molecule
Emp. Form.:
C17H20BrNO
Mol. Mass.:
334.251
SMILES:
Brc1ccc(cc1)C(=O)NC1C2CC3CC(C2)CC1C3 |TLB:19:18:14.13.12:16,THB:19:13:16:10.17.18,9:10:14.13.12:16,14:13:10:15.16.17,14:15:10:13.12.19,(12.3,-17.39,;10.97,-18.17,;10.97,-19.72,;9.64,-20.49,;8.3,-19.72,;8.3,-18.18,;9.63,-17.41,;6.97,-20.49,;6.97,-22.03,;5.63,-19.72,;4.3,-20.49,;4.29,-22.01,;2.89,-22.36,;1.56,-21.87,;.37,-23.15,;1.87,-22.73,;3.27,-23.29,;1.86,-21.14,;2.9,-19.91,;1.56,-20.39,)|
Structure:
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