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Inhibitor Report for: PF-06795071

Name Class
PF-06795071TypeTrifluoro
Carbamate
PET probe
Pyrazole
Other_Name (7)
Chemical_Nomenclature(1,1,1-trifluoro-3-hydroxypropan-2-yl) 6-[1-(4-fluorophenyl)pyrazol-3-yl]-3-azabicyclo[3.1.0]hexane-3-carboxylate
FormulaC18H17F4N3O3
MW399.34
PaperMcAllister_2018_J.Med.Chem_61_3008
Chen_2019_J.Med.Chem_62_8866
Chen_2021_Acta.Pharm.Sin.B_11_1686
Structure6BQ0
CommentIrreversible MAGL inhibitor. The adduct on the active serine without the leaving group is E3A FNIBKVOGYHDUDM-UOIKSKOESA-N. It is the same adduct for PF-06795071 and for compound 10 used in cristallization. [18F]PF06795071 developped as a PET probe
Gene_locushuman-MGLL
CID126506472
FamilyMonoglyceridelipase_lysophospholip
InChIKeyMEDCQBUTCWNKGW-UHFFFAOYSA-N
CanonicalSMILESC1C2C(C2C3=NN(C=C3)C4=CC=C(C=C4)F)CN1C(=O)OC(CO)C(F)(F)F
InChIInChI=1S/C18H17F4N3O3/c19-10-1-3-11(4-2-10)25-6-5-14(23-25)16-12-7-24(8-13(12)16)17(27)28-15(9-26)18(20,21)22/h1-6,12-13,15-16,26H,7-9H2

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Mail to: Nicolas Lenfant, Thierry Hotelier, Yves Bourne, Pascale Marchot and Arnaud Chatonnet.
Please cite: Lenfant 2013 Nucleic.Acids.Res. or Marchot Chatonnet 2012 Prot.Pept Lett.
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