ARUK3004308
General
Type : Fragment inhibitor of Notum, Indole, Organochlorine
Chemical_Nomenclature : 1-(4-chloro-2,3-dihydroindol-1-yl)ethanone
Canonical SMILES : CC(=O)N1CCC2=C1C=CC=C2Cl
InChI : InChI=1S\/C10H10ClNO\/c1-7(13)12-6-5-8-9(11)3-2-4-10(8)12\/h2-4H,5-6H2,1H3
InChIKey : PRQBPDDBVHPKIP-UHFFFAOYSA-N
Other name(s) : RT6 || 1-(4-chloranyl-2,3-dihydroindol-1-yl)ethanone || Compound 4g || SCHEMBL5765327 || ZINC165458219
MW : 195.65
Formula : C10H10ClNO
CAS_number :
PubChem : 69558542
UniChem : PRQBPDDBVHPKIP-UHFFFAOYSA-N
Target
Families : ARUK3004308 ligand of proteins in family
Pectinacetylesterase-Notum
Structure :
8BTA
Protein :
human-NOTUM
References (1)
| Title : Designed switch from covalent to non-covalent inhibitors of carboxylesterase Notum activity - Atkinson_2023_Eur.J.Med.Chem_251_115132 |
| Author(s) : Atkinson BN , Willis NJ , Zhao Y , Patel C , Frew S , Costelloe K , Magno L , Svensson F , Jones EY , Fish PV |
| Ref : Eur Journal of Medicinal Chemistry , 251 :115132 , 2023 |
| Abstract : |
| PubMedSearch : Atkinson_2023_Eur.J.Med.Chem_251_115132 |
| PubMedID: 36934521 |
| Gene_locus related to this paper: human-NOTUM |