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Progress in Chemistry 2007, Vol. 19 Issue (012): 1939-1946 Previous Articles   Next Articles

Special Issue: 计算化学

• Invited Article •

Discovering Potential Drug Leads via Docking, Synthesis and Bioassay

Ye Deju1 ; Luo Xiaomin1 ; Shen Jianhua1 ; Zhu Weiliang1 ; Shen Xu1,2 ; Jiang Hualiang1,2 ; Liu Hong1**

  

  1. (1. The Center for Drug Discovery and Design, State Key Laboratory of Drug Research, Shanghai Institute of Materia Medica, Shanghai Institutes for Biological Sciences, Chinese Academy of Sciences, Shanghai 201203, P. R. China; 2. School of Pharmacy, East China University of Science and Technology, Shanghai, 200237, China)
  • Received: Revised: Online: Published:
  • Contact: Liu Hong
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Discovering potential drug leads has played a key role in the drug development. As a new method or technology for drug discovery, virtual screening via molecular docking has been developed as a practical tool complemented with high throughput empirical screening, and is now a widespread drug lead identification method in the pharmaceutical industry. In this review, we will introduce recent advances in discovering drug leads via docking, synthesis and bioassay focused on our laboratory work.
Key words: drug leads, virtual screening, molecular docking, synthesis, bioassay

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