Computational targeting of allosteric site of MEK1 by quinoline‐based molecules - Singh, Rahul; Bhardwaj, Vijay K.; Purohit, Rituraj (Cell biochemistry and function, 2022)
Keywords: allosteric inhibitors; Allosteric properties; Biodegradability; Biodegradation; Breast; Cell proliferation; Clinical trials; Colon; Comparative analysis; Computer applications; Hydrophobicity; Inhibitors; Kinases; Lung cancer; MD simulations; MEK protein; MEK1; MM‐PBSA; Molecular docking; Molecular dynamics; Organic compounds; Phosphorylation; Quinoline; Quinolines; Toxicity; MD simulations; MM-PBSA; MEK1; allosteric inhibitors; quinolines