Design, synthesis, biological evaluation and molecular docking study of novel pyridoxine-triazoles as anti-Alzheimer's agents

A series of multi-target natural product-pyridoxine based derivatives were designed, synthesized, characterized and evaluated as anti-Alzheimer agents.In vitrotesting revealed the multi-functional properties of compounds such as inhibition of acetylcholinesterase (AChE), antioxidant and metal chelation. Among the series,5iderivative was found most potent AChE inhibitor, possess antioxidant potential and chelating metal ions. Further binding interaction of5iwith AChE was studied using molecular docking, showed interaction with both PAS and CAS site of AChE.In silicopredictions were also performed to predict toxicity and ADME properties of the molecule5iand found within drug likeness range. Therefore,5icould be a promising multi-functional compound that can be used for further development of novel drug for Alzheimer disease.