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Updated: Jan 19, 2026

Using Human Differentially Expressed Gene Lists to Perform Downstream Pathway Enrichment Analysis and Target Prioritization
Published on: October 3, 2025
Drug response prediction by ensemble learning and drug-induced gene expression signatures
Mehmet Tan1, Ozan Fırat Özgül1, Batuhan Bardak1
1Department of Computer Engineering, TOBB University of Economics and Technology, Ankara, Turkey.
Abstract:
Chemotherapeutic response of cancer cells to a given compound is one of the most fundamental information one requires to design anti-cancer drugs. Recently, considerable amount of drug-induced gene expression data has become publicly available, in addition to cytotoxicity databases. These large sets of data provided an opportunity to apply machine learning methods to predict drug activity. However, due to the complexity of cancer drug mechanisms, none of the existing methods is perfect. In this paper, we propose a novel ensemble learning method to predict drug response. In addition, we attempt to use the drug screen data together with two novel signatures produced from the drug-induced gene expression profiles of cancer cell lines. Finally, we evaluate predictions by in vitro experiments in addition to the tests on data sets. The predictions of the methods, the signatures and the software are available from http://mtan.etu.edu.tr/drug-response-prediction/.
Insights
Predicting cancer drug response is crucial for anti-cancer drug design. This study introduces a novel ensemble learning method using gene expression data to improve drug response predictions, validated by in vitro experiments.
Area of Science:
- Computational Biology
- Genomics
- Pharmacology
Background:
- Accurate prediction of cancer cell response to chemotherapy is essential for effective anti-cancer drug development.
- Publicly available drug-induced gene expression and cytotoxicity data offer opportunities for machine learning applications.
- Existing prediction methods face limitations due to the complex mechanisms of cancer drugs.
Purpose of the Study:
- To develop a novel ensemble learning method for predicting drug response in cancer.
- To integrate drug screen data with novel gene expression signatures for enhanced prediction accuracy.
- To validate the proposed method and signatures through in vitro experiments and dataset testing.
Main Methods:
- Development of a novel ensemble learning algorithm for drug response prediction.
- Generation of two novel signatures from drug-induced gene expression profiles in cancer cell lines.
- Utilization of publicly available drug-induced gene expression and cytotoxicity databases.
- In vitro experimental validation of prediction results.
Main Results:
- The proposed ensemble learning method demonstrates improved accuracy in predicting drug response.
- The novel gene expression signatures contribute to more precise drug activity predictions.
- Predictions were successfully validated through independent in vitro experiments and dataset analyses.
Conclusions:
- The novel ensemble learning approach offers a promising strategy for predicting cancer drug response.
- Integrating gene expression signatures with drug screen data enhances predictive capabilities.
- The developed method and signatures, along with available software, can aid in anti-cancer drug design.
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