Microwave-assisted one-pot green synthesis, ADMET profiling, DFT, and molecular docking of novel 3-cyano-2-pyridone derivatives as dual EGFR and cytokine (TNF-α, IL-6) inhibitors
Eslam M Lotfy, Riham M. Bokhtia, Hanan A. Abdel Fattah, Israa A. Seliem
Topics & Concepts
ChemistryEGFR inhibitorsDocking (animal)A549 cellCytotoxicityEpidermal growth factor receptorMTT assayIn silicoFlow cytometryApoptosisCytokinePharmacologyViability assayTumor necrosis factor alphaPharmacophoreCell cultureJurkat cellsCancer cellMolecular modelReceptorCellBiochemistryCell growthCancer researchBiological activitySignal transductionProinflammatory cytokineIn vitroStructure–activity relationshipBinding siteSmall moleculeSynthesis and biological activityMulticomponent Synthesis of HeterocyclesSynthesis and Reactions of Organic Compounds