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Updated: Aug 5, 2026

Drug Repurposing Hypothesis Generation Using the "RE:fine Drugs" System
Published on: December 11, 2016
Automated Processes and Artificial Intelligence in Generating Candidates for Oncology Drug Repurposing: Three-Year
Antonio Ivanov1, Ines Hababa-Ivanova1, Savina Elitova1
1Department of Organization and Economics of Pharmacy, Faculty of Pharmacy, Medical University-Sofia, 2, Dunav Str., 1000 Sofia, Bulgaria.
Abstract:
Oncology conditions are increasingly defined by their molecular profiles, and drug repurposing exploits this new evidence to identify new therapeutic uses of authorized/investigational medicinal products outside their original indication(s). This scoping review mapped original research published between January 2022 and December 2024 to determine the impact of automated processes and artificial intelligence in generating oncology candidates for drug repositioning, and 42 individual projects met the eligibility criteria and were analyzed. The included studies demonstrate extensive use of computational approaches for candidate prioritization, large-scale data integration, and hypothesis generation in oncology drug repurposing, creating opportunities for positive impact on efficiency. The included projects most commonly were target-oriented and disease-oriented and used multiple databases and computational validation procedures, while experimental and clinical validation were less frequently reported. The available open-access literature suggests substantial activity in China and India, which can support the notion that digitalization represents an important instrument in healthcare systems of low- and middle-income countries but should be interpreted cautiously. While the search was limited to PubMed and open-access English-language publications, we identified a relatively small number of drug-oriented projects, the importance of providing publicly accessible source code to reduce development costs, and the predominant role of academic institutions.
Insights
Artificial intelligence and automated processes are enhancing oncology drug repositioning by prioritizing candidates and integrating data. This review highlights computational methods driving efficiency in identifying new cancer therapies.
Area of Science:
- Oncology
- Pharmacology
- Bioinformatics
Background:
- Cancer treatment increasingly relies on molecular profiling.
- Drug repurposing identifies new uses for existing medications.
- Automated processes and AI accelerate drug discovery.
Purpose of the Study:
- To review the impact of AI and automation on oncology drug repositioning.
- To analyze research on computational approaches for identifying new cancer drug candidates.
Main Methods:
- Scoping review of original research from January 2022 to December 2024.
- Analysis of 42 eligible projects focused on AI and automation in oncology drug repurposing.
- Literature search limited to PubMed and open-access English-language publications.
Main Results:
- Extensive use of computational methods for candidate prioritization, data integration, and hypothesis generation.
- Most projects were target-oriented or disease-oriented, with less frequent experimental/clinical validation.
- Significant activity observed in China and India, suggesting digitalization's role in low- and middle-income countries.
- Predominant role of academic institutions and a need for accessible source code.
Conclusions:
- AI and automation significantly improve efficiency in oncology drug repositioning.
- Computational approaches are central, but experimental validation requires more focus.
- Digitalization offers potential for healthcare systems in developing nations, warranting cautious interpretation.
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