Multitargeted Compounds: A Promising Approach in Medicinal Chemistry

Dear Colleagues,

In recent years, the development of novel therapeutic agents with the ability to interact with multiple targets simultaneously has drawn significant attention in the field of medicinal chemistry. These multitargeted compounds offer a new paradigm for drug discovery and hold immense potential for addressing complex diseases with intricate molecular mechanisms. This proposed Special Issue aims to explore the design, synthesis, and application of multitargeted compounds as a promising strategy in the field of medicinal chemistry.

Rational Design of Multitargeted Compounds:

This section aims to explore the rational design principles employed in the creation of multitargeted compounds. It will highlight the importance of structural modifications, molecular docking studies, and computational approaches to optimize the interactions between a compound and multiple targets.

Mechanistic Insights and Synergistic Effects:

Here, the focus will be on elucidating the mechanisms of action of multitargeted compounds. Understanding how these compounds simultaneously modulate multiple targets can provide valuable insights into the synergistic effects and enhanced therapeutic outcomes they offer. The section will showcase case studies that demonstrate the mechanistic basis of multitargeted compound activity.

Therapeutic Applications of Multitargeted Compounds:

This section will explore the diverse therapeutic applications of multitargeted compounds across various disease areas. Examples encompass cancer, neurodegenerative disorders, cardiovascular diseases, infectious diseases, and inflammation. Special emphasis will be placed on the advantages and challenges associated with multitargeted compounds compared to traditional single-target drugs.

Future Perspectives and Emerging Technologies:

The final section will provide an outlook on the future of multitargeted compounds in medicinal chemistry. It will explore emerging technologies, such as artificial intelligence, machine learning, and high-throughput screening, that can facilitate the discovery and optimization of multitargeted compounds. Additionally, potential strategies for translating multitargeted compounds from bench to bedside will be examined.

Prof. Dr. Abdallah Hamze
Guest Editor

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• multitargeted compounds
• medicinal chemistry
• rational design
• drug discovery
• synergistic effects
• emerging technologies
• therapeutic applications
• dual compounds