基于网络药理学的天然药物先导药物发现策略

Shitang Ma, Jiafu Hou, Shijuan Liu, Fucheng Zhu, Peipei Wei, Chengtao Feng, Naidong Chen
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引用次数: 0

摘要

治疗方法需要克服现有疾病的发展,研究发现新的先导剂。面对全球公共卫生挑战,天然药物在创新性先导药物发现中发挥着关键作用。网络药理学可以基于先导化合物、生物功能和生物活性靶蛋白,方便地构建复杂的多药理学网络,既符合天然药物的整体特点,又能在分子-蛋白水平上系统地阐明作用机制。在这项工作中,我们首先总结了近年来的进展,描述了铅药物的开发及其与天然药物的相互作用。其次,我们重点研究了天然药物与网络药理学的关系。此外,我们还讨论了利用网络药理学从天然药物中发现先导药物的现状和潜在前景。进一步的研究应着眼于生物实验的相关结构分析,以及动态和定量的网络发展。综上所述,这是一种创新先导药物发现的合理途径,随着结构和生物学研究的发展,这种途径使其成为先导分子高通量从一个全面而强大的特殊多化合物到靶向蛋白/疾病多药理学网络的非常有力的方法。
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Lead Drug Discover Strategies from Natural Medicines Based on Network Pharmacology.

The need for therapeutics to overcome development of existing diseases research to discover new lead agents. In the face of public health challenges worldwide, natural medicines play a pivotal role in innovative lead drug discovery. Network pharmacology can easily construct complicated poly-pharmacology network based on lead compound, biological function, and bioactive target proteins, which meets the overall feature of natural medicines, and enable to elucidate the action mechanism at molecule-protein level with systematic view. In this work, we first summarized the recent progress delineating lead drug development and its interaction with natural medicines. Second, we focused on the relationship between natural medicines and network pharmacology. Additionally, we discussed current issues and potential prospects for the lead drug discover from natural medicines by network pharmacology. Further investigations should be focus on relevant structural analysis for biological experiment, also the dynamic and quantitative network development. In summary, it is a rational approach for innovative lead drug discovery, and with the development of structure and biology research, this approach makes it a very powerful method for the lead molecules in a high-throughput manner from a comprehensive and powerful special multi-compound to target protein/disease poly pharmacology network.

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