人工智能在低资源环境下的抗病毒药物发现:一个视角

Cyril T. Namba-Nzanguim, Gemma Turon, C. V. Simoben, I. Tietjen, L. Montaner, S. M. Efange, Miquel Duran-Frigola, F. Ntie‐Kang
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引用次数: 1

摘要

目前的抗病毒药物发现工作面临许多挑战,包括在疫情爆发期间开发新药,以及应对因病毒突变快速积累而产生的耐药性。新兴的人工智能和机器学习(AI/ML)方法可以加速抗感染药物的发现,并有可能降低中低收入国家的总体开发成本,这反过来可能有助于在这些国家开发新的和/或可获得的传染病疗法。虽然市场目前提供了大量数据驱动的AI/ML工具,但迄今为止,大多数工具都是在癌症等非传染性疾病的背景下开发的,一些障碍限制了现有工具的转化,使其无法发现抗传染病的药物。在这里,我们提供了一个关于AI/ML工具在发现新疗法中的好处、局限性和陷阱的视角,重点是抗病毒药物。我们还讨论了现有和新兴的数据共享模型,包括知识产权保护AI/ML。此外,我们审查了可用的数据源和平台,并提供了低成本和可访问的筛查方法以及其他适合在LMIC中实施基于AI/ML的程序的基于病毒的生物测定的示例。最后,我们介绍了位于喀麦隆(中非)的一个新兴的基于AI/ML的中心,该中心目前正在开发促进本地独立药物发现的方法和工具,并代表了一种可以在全球LMIC中复制的模式。
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Artificial intelligence for antiviral drug discovery in low resourced settings: A perspective
Current antiviral drug discovery efforts face many challenges, including development of new drugs during an outbreak and coping with drug resistance due to rapidly accumulating viral mutations. Emerging artificial intelligence and machine learning (AI/ML) methods can accelerate anti-infective drug discovery and have the potential to reduce overall development costs in Low and Middle-Income Countries (LMIC), which in turn may help to develop new and/or accessible therapies against communicable diseases within these countries. While the marketplace currently offers a plethora of data-driven AI/ML tools, most to date have been developed within the context of non-communicable diseases like cancer, and several barriers have limited the translation of existing tools to the discovery of drugs against infectious diseases. Here, we provide a perspective on the benefits, limitations, and pitfalls of AI/ML tools in the discovery of novel therapeutics with a focus on antivirals. We also discuss available and emerging data sharing models including intellectual property-preserving AI/ML. In addition, we review available data sources and platforms and provide examples for low-cost and accessible screening methods and other virus-based bioassays suitable for implementation of AI/ML-based programs in LMICs. Finally, we introduce an emerging AI/ML-based Center in Cameroon (Central Africa) which is currently developing methods and tools to promote local, independent drug discovery and represents a model that could be replicated among LMIC globally.
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