新颖性
鉴定(生物学)
药物发现
计算机科学
人工智能
选择(遗传算法)
药物靶点
过程(计算)
机器学习
医学
心理学
生物信息学
生物
药理学
社会心理学
操作系统
植物
作者
Frank W. Pun,Ivan V. Ozerov,Alex Zhavoronkov
标识
DOI:10.1016/j.tips.2023.06.010
摘要
Disease modeling and target identification are the most crucial initial steps in drug discovery, and influence the probability of success at every step of drug development. Traditional target identification is a time-consuming process that takes years to decades and usually starts in an academic setting. Given its advantages of analyzing large datasets and intricate biological networks, artificial intelligence (AI) is playing a growing role in modern drug target identification. We review recent advances in target discovery, focusing on breakthroughs in AI-driven therapeutic target exploration. We also discuss the importance of striking a balance between novelty and confidence in target selection. An increasing number of AI-identified targets are being validated through experiments and several AI-derived drugs are entering clinical trials; we highlight current limitations and potential pathways for moving forward.
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