Artificial Intelligence used in Drug Discovery

The integration of artificial intelligence (AI) in drug discovery has revolutionized the pharmaceutical industry, transforming the way novel therapeutics are developed. AI's ability to analyze vast amounts of data, identify patterns, and predict outcomes has accelerated the discovery process, reducing time and costs. This review highlights the role of AI in drug discovery, from target selection and validation to compound screening and lead optimization. AI-powered tools, such as machine learning algorithms and deep learning models, have been successfully applied in medical diagnoses, cellular image analysis, and chemical synthesis. The advantages of AI in drug discovery include enhanced computational power, improved accuracy, and the ability to identify potential drug candidates. However, limitations such as data quality, lack of originality, and high costs need to be addressed. Applications of AI in drug discovery include targeted therapeutic nanoparticles, drug-drug interaction identification, and clinical trial design. Future directions include the development of more sophisticated AI models, integration with omics research, and personalized medicine. AI is poised to transform the pharmaceutical industry, enabling the development of novel therapeutics and improving treatment outcomes. By leveraging AI's potential, researchers can accelerate the discovery of new drugs, reduce costs, and ultimately improve human health. As the field continues to evolve, it is essential to address the challenges and limitations associated with AI in drug discovery, ensuring the development of effective and safe therapeutics.

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Publication Details

Journal
Zenodo (CERN European Organization for Nuclear Research)
Published
2025-07-30
DOI
https://doi.org/10.5281/zenodo.16990936
Primary Topic
Geochemistry and Geologic Mapping
Type
article
Field-Weighted Citation Impact
0.00
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article

Artificial Intelligence used in Drug Discovery

Zenodo (CERN European Organization for Nuclear Research)
Geochemistry and Geologic Mapping
article

Artificial Intelligence used in Drug Discovery

article en

Abstract

The integration of artificial intelligence (AI) in drug discovery has revolutionized the pharmaceutical industry, transforming the way novel therapeutics are developed. AI's ability to analyze vast amounts of data, identify patterns, and predict outcomes has accelerated the discovery process, reducing time and costs. This review highlights the role of AI in drug discovery, from target selection and validation to compound screening and lead optimization. AI-powered tools, such as machine learning algorithms and deep learning models, have been successfully applied in medical diagnoses, cellular image analysis, and chemical synthesis. The advantages of AI in drug discovery include enhanced computational power, improved accuracy, and the ability to identify potential drug candidates. However, limitations such as data quality, lack of originality, and high costs need to be addressed. Applications of AI in drug discovery include targeted therapeutic nanoparticles, drug-drug interaction identification, and clinical trial design. Future directions include the development of more sophisticated AI models, integration with omics research, and personalized medicine. AI is poised to transform the pharmaceutical industry, enabling the development of novel therapeutics and improving treatment outcomes. By leveraging AI's potential, researchers can accelerate the discovery of new drugs, reduce costs, and ultimately improve human health. As the field continues to evolve, it is essential to address the challenges and limitations associated with AI in drug discovery, ensuring the development of effective and safe therapeutics.

Zenodo (CERN European Organization for Nuclear Research)
Shri Vile Parle Kelavani Mandal (IN)
Openalex Percentile: Top 60%
Geochemistry and Geologic Mapping
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