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ARTIFICIAL INTELLIGENCE IN DRUG RESPONSE PREDICTION AND PHARMACOLOGICAL THERAPY OPTIMIZATION: ADVANCES, CHALLENGES, AND FUTURE PERSPECTIVES

Sep 2026 · European Journal Pharmaceutical and Medical Research

Abstract

Driven by artificial intelligence, or AI, today's medicinal science has the potential of rapidly transforming a doctor's knowledge of patient reactions to a variety of medications. In clinical practice, one has seen that sometimes a given medication is effective and sometimes ineffective in a patient. This difference could be caused by genetics, lifestyle, disease conditions, environmental exposure or none of the above. With the advent of AI, drug response prediction and optimization are now better supported with many various approaches. Random Forest (RF) and Support Vector Machine (SVM) are some of the common machine learning algorithms employed to predict the activity of a particular drug, identify the biomarkers and classify patients as responders and non-responders. These techniques aid doctors with the informed decisions, particularly regarding chemotherapy. Gradient Boosting models also predict clinical risks and bad drug reactions with lot of precision, such as XGBoost, and LightGBM. The use of complex biological patterns by deep learning models is enhancing the field of pharmacology research further. The use of Artificial neural Networks (ANNs) to explore drug interactions with the target and to simulate Pharmacokinetics – the mechanisms of body uptake, distribution and disposition of drugs. CNNs also are extremely effective when performing image analysis tasks, such as detecting tumors or modeling and assessing the effectiveness of cancer medications with medical images. The Recurrent Neural Networks (RNNs) are designed to see data changing over time and so help doctors stay abreast of patients' progress and predict their long-term outcomes. More sophisticated AI techniques are making a large impact too. Graphical models are used to describe complex molecular and drug–drug network data and graphical networks are used in Graph Neural Networks (GNNs) to understand the relationships between different molecules and drugs. This is really important to identify safe and effective combined therapies. Drug Safety Monitoring and Evidence-Based Decision Making can be enhanced through the use of Natural Language Processing (NLP), as this technology can extract valuable information from clinical notes, research articles, and electronic health records. Using Reinforcement Learning (RL), flexible treatment plans can be developed by optimising the dose of drug administration in real-time. Pro-bayarian networks: Bayes models when a doctor doesn’t know what to do. Combination of clinical with multi-omics data (including genomic, transcriptomic, and proteomic data) is one of the most powerful of AI. Such a combination helps understand disease mechanisms and patient variability better, resulting in improved patient stratification, personalized dosages and therapeutic outcomes.

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