计算机科学
化学信息学
药物发现
背景(考古学)
药品
化学空间
计算生物学
生物网络
系统药理学
数据科学
生物信息学
药理学
生物
古生物学
作者
Baptiste Boezio,Karine Audouze,Pierre Ducrot,Olivier Taboureau
标识
DOI:10.1002/minf.201700048
摘要
Abstract In drug discovery, network‐based approaches are expected to spotlight our understanding of drug action across multiple layers of information. On one hand, network pharmacology considers the drug response in the context of a cellular or phenotypic network. On the other hand, a chemical‐based network is a promising alternative for characterizing the chemical space. Both can provide complementary support for the development of rational drug design and better knowledge of the mechanisms underlying the multiple actions of drugs. Recent progress in both concepts is discussed here. In addition, a network‐based approach using drug‐target‐therapy data is introduced as an example.
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