How AI and Quantum Computing are Transforming Drug Discovery and the Healthcare Industry

February 28, 2025

Developing new drugs can be a slow and expensive process, often taking many years of research and costing billions of dollars. Traditional trial and error methods that test countless compounds to see which interactions may result in positive outcomes can be inefficient and often unsuccessful, like searching for a needle in an unfathomably large haystack. Now, new research from the University of Toronto and Insilico Medicine shows how emerging AI and quantum computing technologies may soon revolutionize this process. 

Smarter, Faster Drug Discovery with AI

With the evolution of this new technology, AI can act as a smart assistant for scientists. AI algorithms can analyze massive amounts of data, including information about diseases, molecules, and clinical trials. This helps scientists identify potential drug targets and predict how effective and safe a drug might be. Researchers can also use generative AI to design new molecules with specific properties that could help scientists understand how certain molecules function and how drugs might interact with them. AI can also help in developing medication to target a specific cell or protein, sifting through incredible amounts of information in a fraction of the time it would take a human.

Factor in quantum computing, and this takes things a step further. Quantum computers use the unique power of qubits, allowing them to perform calculations far beyond the capabilities of other computers. The additional processing power can more accurately simulate how molecules interact with each other. This is crucial because the way a drug interacts with molecules in the body can predict whether it will work and if it will have side effects. Quantum computers can explore a much wider range of potential drug candidates, significantly speeding up the search for effective treatments and reducing research and development time from decades to just weeks

AI and Quantum Computing Working Together to Transform Healthcare

The real magic happens when AI and quantum computing work together. AI can guide quantum simulations, telling the quantum computer which molecules to focus on. Then, AI can analyze the results of the quantum simulations to identify which drugs are most likely to work. AI provides the brains and quantum computing provides the power.

The University of Toronto and Insilico Medicine’s work combining traditional computing methods with quantum computing and generative AI is revolutionizing the design of new molecules. They have discovered its potential to target a previously “undruggable” cancer-driving protein. With more than 7,000 diseases having no treatments, this breakthrough could lead to more effective drugs with fewer side effects and lower costs. 

“With computational approaches like this, we have the potential to shorten the preclinical phase of drug discovery by years.” —Igor Stagljar, Professor of Biochemistry and Molecular Genetics, University of Toronto

The combination of AI and quantum computing has the potential to transform the healthcare industry in exciting ways, including:

  • Getting new treatments to patients faster;
  • Making drugs with fewer side effects;
  • Finding effective treatments for previously untreatable diseases; 
  • Lowering drug costs; and
  • Providing more personalized medicine tailored to a patient’s specific genetic makeup.

AI and Quantum Computing at Capitol Tech

The combination of AI and quantum computing presents exciting potential for drug discovery and patient outcomes. At Capitol Technology University, our AI and quantum computing degree programs focus on the research and collaboration needed to develop and ethically manage these systems to bring innovation to all industries, including healthcare. Explore these exciting fields today!

To learn more, contact our Admissions team or request more information.