Abstract

In recent years, the development of novel inhibitors has gained significant attention in various fields, particularly in the pharmaceutical industry. Substituted Pyrimidine derivatives have emerged as promising candidates for designing potent inhibitors due to their versatile chemical properties and potential biological activities. This review provides a comprehensive overview of the synthesis and in silico approaches employed for the design of substituted Pyrimidine derivatives as inhibitors. The review begins by highlighting the significance of Pyrimidine derivatives in drug discovery and their structural diversity. It emphasizes the role of computational tools and techniques in rational drug design, including molecular docking, molecular dynamics simulations, and quantitative structure-activity relationship (QSAR) studies. The integration of experimental and computational methods offers a synergistic approach for the identification and optimization of effective inhibitors. Furthermore, the review delves into the synthetic strategies employed for the preparation of substituted Pyrimidine derivatives. It discusses various synthetic routes, such as condensation, cyclization, and functionalization, showcasing their potential for generating diverse chemical libraries. The comprehensive understanding presented in this review is expected to inspire further advancements in the field of inhibitor design and contribute to the development of innovative therapeutic agents.

Description