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Inhibitor Report for: JW651

JW651 is a potent selective inhibitor of MAGL. JW651 inhibited mouse MAGL with an IC50 ~38 nM


General
Type Piperazine, Halo ketone, Carbamate, Trifluoro
Chemical_Nomenclature 1,1,1,3,3,3-Hexafluoropropan-2-yl 4-(bis(4-chlorophenyl)methyl)piperazine-1-carboxylate
Canonical SMILES C1CN(CCN1C(C2=CC=C(C=C2)Cl)C3=CC=C(C=C3)Cl)C(=O)OC(C(F)(F)F)C(F)(F)F
InChI InChI=1S/C21H18Cl2F6N2O2/c22-15-5-1-13(2-6-15)17(14-3-7-16(23)8-4-14)30-9-11-31(12-10-30)19(32)33-18(20(24,25)26)21(27,28)29/h1-8,17-18H,9-12H2
InChIKey UPIHQFKOCOKGEO-UHFFFAOYSA-N
Other name(s) JW 651 ; JW-651 ; sml0990 ; SCHEMBL15100884 ; BDBM179938 ; ZINC205109968 ; US9133148, 2b
________________________________________________________________________________________________
MW|515.07
Formula|C21H18Cl2F6N2O2
CAS_number|
PubChem|71656315
UniChem|UPIHQFKOCOKGEO-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | JW651 ligand of proteins in family: Monoglyceridelipase_lysophospholip, Plasmodium_subtelomeric_PST-A
Protein | human-MGLL, plafa-PF10.0379

References:
Search PubMed for references concerning: JW651
    Title: Inhibition of Monoacylglycerol Lipase Decreases Angiogenic Features of Endothelial Cells via Release of Tissue Inhibitor of Metalloproteinase-1 from Lung Cancer Cells
    Wittig F, Henkel L, Pruser JL, Merkord J, Ramer R, Hinz B
    Ref: Cells, 12:1757, 2023 : PubMed

            

    Title: The Antimalarial Natural Product Salinipostin A Identifies Essential alpha/beta Serine Hydrolases Involved in Lipid Metabolism in P. falciparum Parasites
    Yoo E, Schulze CJ, Stokes BH, Onguka O, Yeo T, Mok S, Gnadig NF, Zhou Y, Kurita K and Bogyo M <11 more author(s)>
    Ref: Cell Chemical Biology, 27:143, 2020 : PubMed

            

    Title: Proteome-wide reactivity profiling identifies diverse carbamate chemotypes tuned for serine hydrolase inhibition
    Chang JW, Cognetta AB, 3rd, Niphakis MJ, Cravatt BF
    Ref: ACS Chemical Biology, 8:1590, 2013 : PubMed