Synthesis and Biological Evaluation of 2,3,4-Triaryl-1,2,4-oxadiazol-5-ones as p38 MAPK Inhibitors.

Roberto RomeoSalvatore Vincenzo GiofrèMaria A ChiacchioLucia VeltriConsuelo Celesti Daniela Iannazzo

Published in: Molecules (Basel, Switzerland) (2021)

A series of azastilbene derivatives, characterized by the presence of the 1,2,4-oxadiazole-5-one system as a linker of the two aromatic rings of stilbenes, have been prepared as novel potential inhibitors of p38 MAPK. Biological assays indicated that some of the synthesized compounds are endowed with good inhibitory activity towards the kinase. Molecular modeling data support the biological results showing that the designed compounds possess a reasonable binding mode in the ATP binding pocket of p38α kinase with a good binding affinity.

Keyphrases

dna binding
protein kinase
tyrosine kinase
high throughput
big data
risk assessment
machine learning
transcription factor
human health
artificial intelligence
single cell