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Model informed precision medicine of Chinese herbal medicines formulas-A multi-scale mechanistic intelligent model

摘要Recent trends suggest that Chinese herbal medicine formulas(CHM formulas)are promising treatments for complex diseases.To characterize the precise syndromes,precise diseases and precise targets of the precise targets between complex diseases and CHM formulas,we developed an artificial intelligence-based quantitative predictive algorithm(DeepTCM).DeepTCM has gone through multilevel model cali-bration and validation against a comprehensive set of herb and disease data so that it accurately captures the complex cellular signaling,molecular and theoretical levels of traditional Chinese medicine(TCM).As an example,our model simulated the optimal CHM formulas for the treatment of coronary heart disease(CHD)with depression,and through model sensitivity analysis,we calculated the balanced scoring of the formulas.Furthermore,we constructed a biological knowledge graph representing interactions by associating herb-target and gene-disease interactions.Finally,we experimentally confirmed the thera-peutic effect and pharmacological mechanism of a novel model-predicted intervention in humans and mice.This novel multiscale model opened up a new avenue to combine"disease syndrome"and"macro micro"system modeling to facilitate translational research in CHM formulas.

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作者 Yuanyuan Qian [1] Xiting Wang [2] Lulu Cai [3] Jiangxue Han [3] Zhu Huang [1] Yahui Lou [1] Bingyue Zhang [1] Yanjie Wang [1] Xiaoning Sun [4] Yan Zhang [4] Aisong Zhu [1] 学术成果认领
作者单位 Zhejiang Key Laboratory of Blood-Stasis-Toxin Syndrome,Zhejiang Chinese Medical University,Hangzhou,310000,China;Zhejiang Engineering Research Center for"Preventive Treatment"Smart Health of Traditional Chinese Medicine,Zhejiang Chinese Medical University,Hangzhou,310000,China;College of Basic Medical Sciences,Zhejiang Chinese Medical University,Hangzhou,310000,China [1] Academy of Mathematics and Systems Science,Chinese Academy of Sciences,Beijing,100190,China [2] Zhejiang Key Laboratory of Blood-Stasis-Toxin Syndrome,Zhejiang Chinese Medical University,Hangzhou,310000,China;Zhejiang Engineering Research Center for"Preventive Treatment"Smart Health of Traditional Chinese Medicine,Zhejiang Chinese Medical University,Hangzhou,310000,China;College of Basic Medical Sciences,Zhejiang Chinese Medical University,Hangzhou,310000,China;Academy of Chinese Medical Science,Zhejiang Chinese Medical University,Hangzhou,310000,China [3] Affiliated Hospital of Liaoning University of Traditional Chinese Medicine,Shenyang,110032,China [4]
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DOI 10.1016/j.jpha.2023.12.004
发布时间 2024-08-20(万方平台首次上网日期,不代表论文的发表时间)
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药物分析学报(英文版)

药物分析学报(英文版)

2024年14卷4期

585-600页

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