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Inhibitor Report for: Fragment-276

Not inhibitor of Notum. Compound 22 Fragment 276 IC50 93+/-7 microM


General
Type Fragment inhibitor of Notum, Sulfur Compound, Thiadiazol
Chemical_Nomenclature 5-(3-ethoxyphenyl)-1,3,4-thiadiazol-2-amine
Canonical SMILES CCOC1=CC=CC(=C1)C2=NN=C(S2)N
InChI InChI=1S/C10H11N3OS/c1-2-14-8-5-3-4-7(6-8)9-12-13-10(11)15-9/h3-6H,2H2,1H3,(H2,11,13)
InChIKey APEORNRUGDLVDP-UHFFFAOYSA-N
Other name(s) Fragment 276 ; Compound 22 ; T2H ; CBMicro_010851 ; Cambridge id 6079840 ; Oprea1_212165 ; Oprea1_803998 ; SCHEMBL20703807 ; ZINC449195
________________________________________________________________________________________________
MW|221.28
Formula|C10H11N3OS
CAS_number|
PubChem|879253
UniChem|APEORNRUGDLVDP-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | Fragment-276 ligand of proteins in family: Pectinacetylesterase-Notum
Stucture | 1 structure: 7B8Y: Structure of the human Wnt deacylase Notum in complex with fragment 276
Protein | human-NOTUM

References:
Search PubMed for references concerning: Fragment-276
    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