Artificial Intelligence (AI) For Drug Development And Discovery Market

By Application;

Drug Optimization & Repurposing, Preclinical Testing and Others

By Therapeutic Area;

Oncology, Neurodegenerative Diseases, Cardiovascular Disease, Metabolic Diseases, Infectious Disease and Others

By Geography;

North America, Europe, Asia Pacific, Middle East & Africa, and Latin America - Report Timeline (2021 - 2031)
Report ID: Rn026524237 Published Date: September, 2025 Updated Date: October, 2025

Artificial Intelligence For Drug Development And Discovery Market Overview

Artificial Intelligence For Drug Development And Discovery Market (USD Million)

Artificial Intelligence For Drug Development And Discovery Market was valued at USD 2,318.61 million in the year 2024. The size of this market is expected to increase to USD 16,449.26 million by the year 2031, while growing at a Compounded Annual Growth Rate (CAGR) of 32.3%.


Artificial Intelligence (AI) For Drug Development And Discovery Market

*Market size in USD million

CAGR 32.3 %


Study Period2025 - 2031
Base Year2024
CAGR (%)32.3 %
Market Size (2024)USD 2,318.61 Million
Market Size (2031)USD 16,449.26 Million
Market ConcentrationLow
Report Pages311
2,318.61
2024
16,449.26
2031

Major Players

  • Alphabet Inc
  • Atomwise, Inc
  • Benevolent AI
  • Cloud Pharmaceutical
  • Deep Genomics
  • Exscientia
  • IBM Corporation
  • Insilico Medicine Inc

Market Concentration

Consolidated - Market dominated by 1 - 5 major players

Artificial Intelligence (AI) For Drug Development And Discovery Market

Fragmented - Highly competitive market without dominant players


The Artificial Intelligence For Drug Development And Discovery Market is redefining drug development by accelerating discovery and boosting accuracy. Close to 60% of leading pharma companies now rely on AI-powered platforms to improve molecule identification and streamline trial execution. Through predictive insights and algorithmic modeling, AI is enabling quicker transitions from lab research to clinical success.

Boosting R&D Productivity
AI adoption is driving stronger outcomes in research and development by cutting down both cost and time. Studies reveal that 55% of early R&D teams achieve higher success rates when using AI simulations to test drug candidates. Virtual screening reduces laboratory failures, enabling precision-focused approaches and paving the way for faster and more efficient breakthroughs.

AI Driving Personalized Healthcare
The rise of personalized medicine is being fueled by AI’s ability to interpret genetic and patient-level data. More than 65% of innovators note its effectiveness in identifying biomarkers and aligning therapies to individual needs. By predicting patient responses, AI not only improves therapeutic efficiency but also reduces side effects, elevating overall healthcare standards.

Cutting Costs and Shortening Timelines
A major advantage of AI lies in its ability to lower costs and speed up outcomes. Surveys indicate that half of biotech organizations achieve significant savings by automating data handling, trial monitoring, and candidate optimization with AI tools. The streamlined processes allow faster progression across stages while ensuring reduced financial strain.

  1. Introduction
    1. Research Objectives and Assumptions
    2. Research Methodology
    3. Abbreviations
  2. Market Definition & Study Scope
  3. Executive Summary
    1. Market Snapshot, By Application
    2. Market Snapshot, By Therapeutic Area
    3. Market Snapshot, By Region
  4. Artificial Intelligence For Drug Development And Discovery Market Dynamics
    1. Drivers, Restraints and Opportunities
      1. Drivers
        1. Increasing prevalence of chronic diseases
        2. Rising healthcare expenditure globally
        3. Expedited drug development timelines with AI
        4. Enhanced accuracy in drug design and molecular modeling
      2. Restraints
        1. Complex regulatory landscape in healthcare
        2. Lack of skilled professionals in AI and drug development
        3. Integration challenges with existing pharmaceutical systems
      3. Opportunities
        1. Integration of AI with other technologies like IoT and big data
        2. Adoption of AI for real-time data analysis in clinical trials
        3. Potential for AI in predicting drug interactions and side effects
        4. Enhancing research efficiency through AI automation
    2. PEST Analysis
      1. Political Analysis
      2. Economic Analysis
      3. Social Analysis
      4. Technological Analysis
    3. Porter's Analysis
      1. Bargaining Power of Suppliers
      2. Bargaining Power of Buyers
      3. Threat of Substitutes
      4. Threat of New Entrants
      5. Competitive Rivalry
  5. Market Segmentation
    1. Artificial Intelligence (AI) For Drug Development And Discovery Market, By Application, 2021 - 2031 (USD Million)
      1. Drug Optimization & Repurposing
      2. Preclinical Testing
      3. Others
    2. Artificial Intelligence (AI) For Drug Development And Discovery Market, By Therapeutic Area, 2021 - 2031 (USD Million)
      1. Oncology
      2. Neurodegenerative Diseases
      3. Cardiovascular Disease
      4. Metabolic Diseases
      5. Infectious Disease
      6. Others
    3. Artificial Intelligence For Drug Development And Discovery Market, By Geography, 2021 - 2031 (USD Million)
      1. North America
        1. United States
        2. Canada
      2. Europe
        1. Germany
        2. United Kingdom
        3. France
        4. Italy
        5. Spain
        6. Nordic
        7. Benelux
        8. Rest of Europe
      3. Asia Pacific
        1. Japan
        2. China
        3. India
        4. Australia & New Zealand
        5. South Korea
        6. ASEAN (Association of South East Asian Countries)
        7. Rest of Asia Pacific
      4. Middle East & Africa
        1. GCC
        2. Israel
        3. South Africa
        4. Rest of Middle East & Africa
      5. Latin America
        1. Brazil
        2. Mexico
        3. Argentina
        4. Rest of Latin America
  6. Competitive Landscape Analysis
    1. Company Profiles
      1. Exscientia
      2. Insilico Medicine
      3. BenevolentAI
      4. Atomwise
      5. Recursion Pharmaceuticals
      6. Aitia
      7. Isomorphic Labs (Alphabet)
      8. Deep Genomics
      9. insitro
      10. Valo Health
      11. Verge Genomics
      12. BioXcel Therapeutics
      13. Peptilogics
      14. Auransa
      15. Ardigen
  7. Analyst Views
  8. Future Outlook of the Market