Inhibitor

Bibliography

Biblio print

Tree Display

AceDB Schema

XML Display

Feedback

Inhibitor Report for: ARUK3001185

Inhibitor of Notum. Compound 8l in Willis et al.2022 Compound 7d in Zhao et al. 2022 IC50 Notum 6.7 +/- 1.6 nM EC50 110 nM


General
Type Trifluoro, Triazol
Chemical_Nomenclature 1-(2,4-Dichloro-3-(trifluoromethyl)phenyl)-1H-1,2,3-triazole
Canonical SMILES C1=CC(=C(C(=C1N2C=CN=N2)Cl)C(F)(F)F)Cl
InChI InChI=1S/C9H4Cl2F3N3/c10-5-1-2-6(17-4-3-15-16-17)8(11)7(5)9(12,13)14/h1-4H
InChIKey XVFXHCLMGYJAQI-UHFFFAOYSA-N
Other name(s) Compound 7d ; 8l ; SCHEMBL21792325
________________________________________________________________________________________________
MW|282.05
Formula|C9H4Cl2F3N3
CAS_number|
PubChem|146438044
UniChem|XVFXHCLMGYJAQI-UHFFFAOYSA-N
IUPHAR|
Wikipedia|

Target
Families | ARUK3001185 ligand of proteins in family: Pectinacetylesterase-Notum
Stucture | 1 structure: 7PK3: Structure of the Wnt deacylase Notum in complex with ARUK3001185
Protein | human-NOTUM

References:
Search PubMed for references concerning: ARUK3001185

2 more
    Title: Design of a potent, selective and brain penetrant inhibitor of Wnt-deactivating enzyme Notum by optimization of a crystallographic fragment hit
    Willis NJ, Mahy W, Sipthorp J, Zhao Y, Woodward HL, Atkinson BN, Bayle ED, Svensson F, Frew S and Fish PV <14 more author(s)>
    Ref: Journal of Medicinal Chemistry, :, 2022 : PubMed

            

    Title: Carboxylesterase Notum Is a Druggable Target to Modulate Wnt Signaling
    Bayle ED, Svensson F, Atkinson BN, Steadman D, Willis NJ, Woodward HL, Whiting P, Vincent JP, Fish PV
    Ref: Journal of Medicinal Chemistry, :, 2021 : PubMed

            

    Title: Small-molecule inhibitors of carboxylesterase Notum
    Zhao Y, Jolly S, Benvegnu S, Jones EY, Fish PV
    Ref: Future Med Chem, :, 2021 : PubMed