Not inhibitor of Notum IC50 140+/-31 microM
Type : Urea derivative, Fragment inhibitor of Notum, Benzoxadiazole
Chemical_Nomenclature : N-(2,1,3-benzoxadiazol-4-yl)acetamide
Canonical SMILES : CC(=O)NC1=CC=CC2=NON=C21
InChI : InChI=1S\/C8H7N3O2\/c1-5(12)9-6-3-2-4-7-8(6)11-13-10-7\/h2-4H,1H3,(H,9,12)
InChIKey : JJHRQXVBTBBRGJ-UHFFFAOYSA-N
Other name(s) : WKA || N-(2,1,3-Benzoxadiazol-4-yl)acetamide || 4-Acetamidobenzofurazan || Acetamide, N-2,1,3-benzoxadiazol-4-yl- || N-(Benzofurazane-4-yl)acetamide || ZINC291833
Families : Fragment-063-notum-screen ligand of proteins in family
Pectinacetylesterase-Notum
Structure :
7B7X
Protein :
human-NOTUM
Title : Structural Analysis and Development of Notum Fragment Screening Hits - Zhao_2022_ACS.Chem.Neurosci_13_2060 |
Author(s) : Zhao Y , Mahy W , Willis NJ , Woodward HL , Steadman D , Bayle ED , Atkinson BN , Sipthorp J , Vecchia L , Ruza RR , Harlos K , Jeganathan F , Constantinou S , Costa A , Kjaer S , Bictash M , Salinas PC , Whiting P , Vincent JP , Fish PV , Jones EY |
Ref : ACS Chem Neurosci , 13 :2060 , 2022 |
Abstract : |
PubMedSearch : Zhao_2022_ACS.Chem.Neurosci_13_2060 |
PubMedID: 35731924 |
Gene_locus related to this paper: human-NOTUM |