Acta Phys. -Chim. Sin. ›› 2008, Vol. 24 ›› Issue (04): 547-551.doi: 10.3866/PKU.WHXB20080401

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Target-Ligand Space Distribution of the Compound Sets from Xuefu Zhuyu Decoction, a Traditional ChineseMedicinal Recipe

LI Xu-Dong; HUANG Qin; XU Xiao-Jie   

  1. College of Chemistry and Molecular Engineering, Peking University, Beijing 100871, P. R. China
  • Received:2007-10-23 Revised:2007-12-26 Published:2008-04-07
  • Contact: XU Xiao-Jie E-mail:xiaojxu@pku.edu.cn

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Abstract: Target-ligand space distributions of the molecules in Xuefu Zhuyu decoction (XFZYD), a traditional Chinese medicinal recipe, on four common cardiovascular target enzymes, which were renin, angiotensin-converting enzyme I (ACE I), 3-hydro-3-methyl glutaryl coenzyme A reductase (HMG-CoAR) and P-glycoproteins (P-gp), were studied.

Key words: Traditional Chinese herbs (TCHs), Xuefu zhuyu decoction, Chemical space, Target-ligand space, Medicinal chemistry