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Inhibitor Report for: Fragment-927

Not inhibitor of Notum. Compound 56 Fragment 927 IC50 >100 microM


General
Type Fragment inhibitor of Notum, Piperazine
Chemical_Nomenclature 4-(2-phenoxyacetyl)piperazin-2-one
Canonical SMILES C1CN(CC(=O)N1)C(=O)COC2=CC=CC=C2
InChI InChI=1S/C12H14N2O3/c15-11-8-14(7-6-13-11)12(16)9-17-10-4-2-1-3-5-10/h1-5H,6-9H2,(H,13,15)
InChIKey VQOCCTAPSDVOOO-UHFFFAOYSA-N
Other name(s) Fragment 927 ; Compound 56 ; TEH ; 4-(phenoxyacetyl)-2-piperazinone ; 4-(2-phenoxyethanoyl)piperazin-2-one ; MLS000103401 ; CHEMBL1468944 ; ZINC359136
________________________________________________________________________________________________
MW|234.25
Formula|C12H14N2O3
CAS_number|587850-66-6
PubChem|833616
UniChem|VQOCCTAPSDVOOO-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | Fragment-927 ligand of proteins in family: Pectinacetylesterase-Notum
Stucture | 1 structure: 7BDF: Structure of the Wnt deacylase Notum in complex with fragment 927
Protein | human-NOTUM

References:
Search PubMed for references concerning: Fragment-927
    Title: Structural Analysis and Development of Notum Fragment Screening Hits
    Zhao Y, Mahy W, Willis NJ, Woodward HL, Steadman D, Bayle ED, Atkinson BN, Sipthorp J, Vecchia L and Jones EY <11 more author(s)>
    Ref: ACS Chem Neurosci, 13:2060, 2022 : PubMed