SCHEMBL23894264
Compound 40, reversible and competitive MAGL inhibitor (IC50 = 0.34 microM)
General
Type : Biphenyl
Chemical_Nomenclature : N-[5-(3-fluoro-4-hydroxyphenyl)-2-hydroxyphenyl]-4-phenylbutanamide || N-(3-fluoro-4,4-dihydroxy-[1,1-biphenyl]-3-yl)-4-phenylbutanamide
Canonical SMILES : C1=CC=C(C=C1)CCCC(=O)NC2=C(C=CC(=C2)C3=CC(=C(C=C3)O)F)O
InChI : InChI=1S\/C22H20FNO3\/c23-18-13-16(9-11-20(18)25)17-10-12-21(26)19(14-17)24-22(27)8-4-7-15-5-2-1-3-6-15\/h1-3,5-6,9-14,25-26H,4,7-8H2,(H,24,27)
InChIKey : XVJRJACAOSBTGJ-UHFFFAOYSA-N
Other name(s) : Compound 40
MW : 365.4
Formula : C22H20FNO3 || C22H19FNO3
CAS_number :
PubChem : 166777863
UniChem : XVJRJACAOSBTGJ-UHFFFAOYSA-N
Target
Families : SCHEMBL23894264 ligand of proteins in family
Monoglyceridelipase_lysophospholip
Protein :
human-MGLL
References (1)
| Title : Discovery of reversible monoacylglycerol lipase (MAGL) inhibitors based on ortho-hydroxyanilide scaffold - Bononi_2025_Bioorg.Chem_163_108698 |
| Author(s) : Bononi G , Gado F , Masoni S , Scalabrini D , Vedova LD , Di Stefano M , Piazza L , Poles C , Lonzi C , Landucci E , Vagaggini C , Poggialini F , Brai A , Caligiuri I , Rizzolio F , Mohamed KA , Bertini S , De Lorenzi E , Dreassi E , Macchia M , Minutolo F , Laprairie RB , Granchi C , Tuccinardi T |
| Ref : Bioorg Chem , 163 :108698 , 2025 |
| Abstract : |
| PubMedSearch : Bononi_2025_Bioorg.Chem_163_108698 |
| PubMedID: 40554889 |
| Gene_locus related to this paper: human-MGLL |