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Inhibitor Report for: Fragment-916

Not inhibitor of Notum. Compound 53 Fragment 916 IC50 > 980+/-17 microM


General
Type Fragment inhibitor of Notum, Carboxamide
Chemical_Nomenclature 3-ethyl-5-methyl-N-(5-methyl-1,2-oxazol-3-yl)-1,2-oxazole-4-carboxamide
Canonical SMILES CCC1=NOC(=C1C(=O)NC2=NOC(=C2)C)C
InChI InChI=1S/C11H13N3O3/c1-4-8-10(7(3)17-13-8)11(15)12-9-5-6(2)16-14-9/h5H,4H2,1-3H3,(H,12,14,15)
InChIKey OZMHRDLCZDDXRS-UHFFFAOYSA-N
Other name(s) Fragment 916 ; Compound 53 ; NW7 ; Oprea1_745129 ; ZINC373530 ; STK431262
________________________________________________________________________________________________
MW|235.24
Formula|C11H13N3O3
CAS_number|438224-38-5
PubChem|842858
UniChem|OZMHRDLCZDDXRS-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | Fragment-916 ligand of proteins in family: Pectinacetylesterase-Notum
Stucture | 1 structure: 7BDB: Structure of the human Wnt deacylase Notum in complex with fragment 916
Protein | human-NOTUM

References:
Search PubMed for references concerning: Fragment-916
    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