Benzotriazole-39-JV5
General
Type : Triazol
Chemical_Nomenclature : N-(2H-Benzotriazol-5-yl)-2-(2-methylphenoxy)acetamide
Canonical SMILES : Cc1ccccc1OCC(=O)Nc1ccc2[nH]nnc2c1
InChI : InChI=1S\/C15H14N4O2\/c1-10-4-2-3-5-14(10)21-9-15(20)16-11-6-7-12-13(8-11)18-19-17-12\/h2-8H,9H2,1H3,(H,16,20)(H,17,18,19)
InChIKey : VIBQPIOMWNLUQT-UHFFFAOYSA-N
Other name(s) : JV5
MW : 282.30
Formula : C15H14N4O2
CAS_number :
PubChem : 138115403
UniChem : VIBQPIOMWNLUQT-UHFFFAOYSA-N
IUPHAR :
Wikipedia :
Target
Families : Benzotriazole-39-JV5 ligand of proteins in family: Pectinacetylesterase-Notum
Stucture : 6R8Q Structure of the human Wnt deacylase Notum in complex with a benzotriazole fragment JV5
Protein : human-NOTUM
References (1)
| Title : Discovery of 2-phenoxyacetamides as inhibitors of the Wnt-depalmitoleating enzyme NOTUM from an X-ray fragment screen - Atkinson_2019_Medchemcomm_10_1361 |
| Author(s) : Atkinson BN , Steadman D , Zhao YG , Sipthorp J , Vecchia L , Ruza RR , Jeganathan F , Lines G , Frew S , Monaghan A , Kjaer S , Bictash M , Jones Y , Fish PV , Zhao Y , Jones EY |
| Ref : Medchemcomm , 10 :1361 , 2019 |
| Abstract : Atkinson_2019_Medchemcomm_10_1361 |
| ESTHER : Atkinson_2019_Medchemcomm_10_1361 |
| PubMedSearch : Atkinson_2019_Medchemcomm_10_1361 |
| PubMedID: 31534655 |
| Gene_locus related to this paper: human-NOTUM |