Artificial Intelligence in Drug Discovery and Development Market Size, Share, Trends & Competitive Analysis By Type (Machine Learning, Deep Learning, Natural Language Processing, Computer Vision, Knowledge Representation and Reasoning) By Application; By End User; By Regions, and Industry Forecast, Global Report 2023-2030

The global Artificial Intelligence in Drug Discovery and Development Market size was valued at USD 1.10 billion in 2022 and is projected to expand at a compound annual growth rate (CAGR) of 30.2% during the forecast period, reaching a value of USD 13.98 billion by 2030.

Artificial Intelligence in Drug Discovery and Development Market research report by Future Data Stats, offers a comprehensive view of the market's historical data from 2017 to 2021, capturing trends, growth patterns, and key drivers. It establishes 2021 as the base year, analyzing the market landscape, consumer behavior, competition, and regulations. Additionally, the report presents a well-researched forecast period from 2022 to 2030, leveraging data analysis techniques to project the market's growth trajectory, emerging opportunities, and anticipated challenges.


Artificial Intelligence in Drug Discovery and Development refers to the application of advanced computational techniques and algorithms to enhance the process of discovering and developing new pharmaceutical drugs. It involves the integration of various AI technologies such as machine learning, deep learning, natural language processing, and computer vision to analyze vast amounts of biological data and identify potential drug targets, optimize drug design, predict drug-drug interactions, and streamline clinical trial processes. By leveraging AI in drug discovery and development, researchers and pharmaceutical companies aim to accelerate the identification of promising drug candidates, reduce costs, and increase the overall success rate of bringing safe and effective medications to market.

In essence, Artificial Intelligence in Drug Discovery and Development holds significant promise in revolutionizing the pharmaceutical industry. By harnessing the power of AI to analyze complex biological data and facilitate data-driven decision-making, researchers can expedite the drug development timeline and potentially address previously untreatable diseases. The integration of AI technologies in this field is a critical step toward advancing precision medicine and improving patient outcomes by enabling more targeted and efficient drug development processes. However, challenges such as data quality, regulatory considerations, and ethical concerns remain important factors that require careful consideration as AI continues to reshape drug discovery and development practices.


The Artificial Intelligence in Drug Discovery and Development market is driven by several factors that are shaping its growth and adoption. One of the primary drivers is the increasing need for faster and more efficient drug development processes. Traditional drug discovery methods are time-consuming and costly, often leading to a high failure rate of drug candidates. AI technologies offer the potential to streamline these processes by analyzing vast amounts of data, predicting drug interactions, and identifying promising drug targets, ultimately accelerating the overall drug development timeline.

Despite the significant potential, the market also faces certain restraints. Data privacy and security concerns are a major factor inhibiting the widespread implementation of AI in drug discovery. Pharmaceutical companies deal with sensitive patient data and proprietary research, making data protection a critical issue. Moreover, the complexity of integrating AI into existing drug development workflows and the need for specialized expertise are challenges that must be addressed to fully harness the benefits of AI in the pharmaceutical industry. However, amidst these challenges lie opportunities for market growth. The rise of collaborative efforts between pharmaceutical companies and AI technology providers, along with advancements in AI algorithms and computing power, presents a promising landscape for the continued evolution and successful integration of Artificial Intelligence in Drug Discovery and Development.



These AI techniques are revolutionizing the pharmaceutical industry by enhancing drug discovery processes, optimizing drug design, and expediting clinical trial operations. Machine Learning and Deep Learning algorithms analyze vast datasets to identify potential drug targets and optimize drug molecules, while NLP and Computer Vision enable the efficient extraction of valuable insights from scientific literature and medical images. Additionally, Knowledge Representation and Reasoning facilitate the integration of diverse data sources, aiding researchers in making informed decisions during the drug development journey. With these dominant factors at play, Artificial Intelligence continues to pave the way for transformative advancements in drug discovery and development, ultimately striving to bring safer and more effective medications to patients worldwide.


Target Identification and Validation, Drug Design and Optimization, Virtual Screening, Biomarker Discovery, Personalized Medicine, Clinical Trial Design and Optimization, Drug Repurposing, Toxicity Prediction, and Data Mining and Analysis are the key applications that benefit from AI technologies. These applications leverage AI's capabilities to analyze vast datasets, identify potential drug targets, optimize drug design, predict drug toxicity, and facilitate personalized medicine approaches. Additionally, AI-powered virtual screening expedites the identification of promising drug candidates, while drug repurposing efforts are being enhanced through data mining and analysis. The integration of Artificial Intelligence across these crucial applications is revolutionizing the drug discovery and development landscape, holding great promise for accelerating the delivery of innovative and life-changing therapies to patients worldwide.


Pharmaceutical companies, biotechnology companies, contract research organizations (CROs), and academic and research institutions are the key stakeholders benefitting from AI technologies. These end users leverage AI's capabilities to streamline drug discovery processes, optimize drug design, and enhance clinical trial operations. Pharmaceutical and biotechnology companies utilize AI to identify potential drug targets, predict drug interactions, and expedite the development of novel therapeutics. Contract research organizations leverage AI to analyze vast datasets and provide valuable insights for drug development projects. Academic and research institutions harness AI's power for data mining, knowledge representation, and drug repurposing efforts, contributing to advancements in drug discovery and development.


North America remains at the forefront of AI adoption in drug discovery, driven by a robust healthcare infrastructure, substantial research investments, and the presence of leading pharmaceutical companies. Europe also embraces AI technologies in drug development, benefiting from supportive regulatory frameworks and collaborative efforts between academia and industry. Meanwhile, the Asia Pacific region is rapidly emerging as a key player in the market, fueled by advancements in technology, growing research capabilities, and increasing investments in healthcare and pharmaceutical sectors. Latin America and the Middle East and Africa are witnessing gradual adoption, with a rising focus on AI implementation to enhance drug discovery processes and improve patient outcomes.


The COVID-19 pandemic has significantly impacted the Artificial Intelligence in Drug Discovery and Development market, driving both challenges and opportunities. With the urgent need for effective treatments and vaccines, the adoption of AI technologies in drug discovery has accelerated to expedite the development process. AI's ability to analyze vast datasets and predict drug interactions has been crucial in identifying potential drug candidates for COVID-19 treatment. Moreover, AI-driven virtual screening and drug repurposing efforts have played a pivotal role in exploring existing drugs for their potential efficacy against the virus. However, the pandemic also posed challenges such as disruptions in clinical trials, data collection, and research funding uncertainties, impacting the overall progress in some areas. Despite these obstacles, the pandemic has underscored the importance of AI in drug development, emphasizing its role in advancing healthcare innovation and preparedness for future health crises.


Mergers & Acquisitions:

  • In June 2023, Eli Lilly acquired Dice Therapeutics for $2.4 billion.
  • In April 2023, GSK acquired Bellus Health Inc. for nearly $2 billion.
  • In March 2023, Sanofi acquired Provention Bio for $2.9 billion.

Product New Launches:

  • In October 2022, BenevolentAI launched two new AI-generated targets for AstraZeneca's R&D portfolio.
  • In November 2022, Insilico Medicine signed a deal with Sanofi for discovering up to six new targets leveraging Insilico Medicine's “Pharma.AI” platform.
  • In January 2023, Cyclica launched Clara Discovery, a collection of frameworks, applications, and AI models enabling GPU-accelerated drug discovery.


  • Pfizer Inc.
  • Novartis AG
  • Merck & Co., Inc.
  • Johnson & Johnson
  • AstraZeneca PLC
  • Roche Holding AG
  • GlaxoSmithKline PLC
  • Sanofi SA
  • Eli Lilly and Company
  • Bristol Myers Squibb Company
  • AbbVie Inc.
  • Gilead Sciences, Inc.
  • Amgen Inc.
  • Takeda Pharmaceutical Company Limited
  • Bayer AG
  • Biogen Inc.
  • Moderna, Inc.
  • Vertex Pharmaceuticals Incorporated
  • Regeneron Pharmaceuticals, Inc.
  • Alexion Pharmaceuticals, Inc.
  • BioNTech SE
  • Celgene Corporation
  • Incyte Corporation
  • Jazz Pharmaceuticals plc
  • Galapagos NV

Table of Contents

Executive Summary

2.1. Overview of Artificial Intelligence in Drug Discovery and Development
2.2. Scope of the Report
2.3. Methodology

Market Landscape
3.1. Market Size and Forecast
3.2. Market Drivers
3.3. Market Challenges
3.4. Market Trends

AI Technologies in Drug Discovery and Development
4.1. Machine Learning
4.2. Deep Learning
4.3. Natural Language Processing (NLP)
4.4. Computer Vision
4.5. Knowledge Representation and Reasoning

AI Applications in Drug Discovery and Development
5.1. Target Identification and Validation
5.2. Drug Design and Optimization
5.3. Virtual Screening
5.4. Biomarker Discovery
5.5. Personalized Medicine
5.6. Clinical Trial Design and Optimization
5.7. Drug Repurposing
5.8. Toxicity Prediction
5.9. Data Mining and Analysis

AI Adoption in Drug Development Process
6.1. Preclinical Development
6.2. Clinical Development
6.3. Regulatory Approval
6.4. Post-Market Surveillance

End Users of AI in Drug Discovery and Development
7.1. Pharmaceutical Companies
7.2. Biotechnology Companies
7.3. Contract Research Organizations (CROs)
7.4. Academic and Research Institutions

Regional Analysis
8.1. North America
8.2. Europe
8.3. Asia Pacific
8.4. Latin America
8.5. Middle East and Africa

Competitive Landscape
9.1. Key Players Overview
9.2. Company Profiles
9.2.1. Company A
9.2.2. Company B
9.2.3. Company C
9.3. Strategic Developments

Future Outlook and Opportunities
10.1. Emerging Trends
10.2. Future Prospects


12.1. List of Abbreviations
12.2. Methodology
12.3. Research Sources

Artificial Intelligence in Drug Discovery and Development Market Segmentation

By Type:

  • Machine Learning
  • Deep Learning
  • Natural Language Processing (NLP)
  • Computer Vision
  • Knowledge Representation and Reasoning

By Application:

  • Target Identification and Validation
  • Drug Design and Optimization
  • Virtual Screening
  • Biomarker Discovery
  • Personalized Medicine
  • Clinical Trial Design and Optimization
  • Drug Repurposing
  • Toxicity Prediction
  • Data Mining and Analysis

By End User:

  • Pharmaceutical Companies
  • Biotechnology Companies
  • Contract Research Organizations (CROs)
  • Academic and Research Institutions


By Geography:

  • North America (USA, Canada, Mexico)
  • Europe (Germany, UK, France, Russia, Italy, Rest of Europe)
  • Asia-Pacific (China, Japan, South Korea, India, Southeast Asia, Rest of Asia-Pacific)
  • South America (Brazil, Argentina, Columbia, Rest of South America)
  • Middle East and Africa (Saudi Arabia, UAE, Egypt, Nigeria, South Africa, Rest of MEA)

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With a collective industry experience of about 70 years of analysts and experts, Future Data Stats encompasses the most infallible research methodology for its market intelligence and industry analysis. Not only does the company dig deep into the innermost levels of the market, but also examines the minutest details for its market estimates and forecasts.

This approach helps build a greater market-specific view of size, shape, and industry trends within each industry segment. Various industry trends and real-time developments are factored into identifying key growth factors and the future course of the market. The research proceeds are the results of high-quality data, expert views & analysis, and valuable independent opinions. The research process is designed to deliver a balanced view of the global markets and allows stakeholders to make informed decisions, to attain their highest growth objectives.

Future Data Stats offers its clients exhaustive research and analysis, based on a wide variety of factual inputs, which largely include interviews with industry participants, reliable statistics, and regional intelligence. The in-house industry experts play an instrumental role in designing analytic tools and models, tailored to the requirements of a particular industry segment. These analytical tools and models distill the data & statistics and enhance the accuracy of our recommendations and advice.

With Future Data Stats calibrated research process and 360° data-evaluation methodology, the clients receive:

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  • Technologically sophisticated and reliable insights through a well-audited and veracious research methodology
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With this strong methodology, Future Data Stats ensures that its research and analysis is most reliable and guarantees sound business planning.

The research methodology of the global market involves extensive primary and secondary research. Primary research includes about 24 hours of interviews and discussions with a wide range of stakeholders that include upstream and downstream participants. Primary research typically is a bulk of our research efforts, coherently supported by extensive secondary research. Over 3000 product literature, industry releases, annual reports, and other such documents of key industry participants have been reviewed to obtain a better market understanding and gain enhanced competitive intelligence. In addition, authentic industry journals, trade associations’ releases, and government websites have also been reviewed to generate high-value industry insights.

Primary Research:

Primary Research


Desk Research


Company Analysis


•       Identify key opinion leaders

•       Questionnaire design

•       In-depth Interviews

•       Coverage across the value chain


•       Company Website

•       Company Annual Reports

•       Paid Databases

•       Financial Reports


•       Market Participants

•       Key Strengths

•       Product Portfolio

•       Mapping as per Value Chain

•       Key focus segment


Primary research efforts include reaching out to participants through emails, telephonic conversations, referrals, and professional corporate relations with various companies that make way for greater flexibility in reaching out to industry participants and commentators for interviews and discussions.

The aforementioned helps to:

  • Validate and improve data quality and strengthen the research proceeds
  • Develop a market understanding and expertise
  • Supply authentic information about the market size, share, growth, and forecasts

The primary research interview and discussion panels comprise experienced industry personnel.

These participants include, but are not limited to:

  • Chief executives and VPs of leading corporations specific to an industry
  • Product and sales managers or country heads; channel partners & top-level distributors; banking, investments, and valuation experts
  • Key opinion leaders (KOLs)

Secondary Research:

A broad array of industry sources for the secondary research typically includes, but is not limited to:

  • Company SEC filings, annual reports, company websites, broker & financial reports, and investor  presentations for a competitive scenario and shape of the industry
  • Patent and regulatory databases to understand technical & legal developments
  • Scientific and technical writings for product information and related preemptions
  • Regional government and statistical databases for macro analysis
  • Authentic news articles, web-casts, and other related releases to evaluate the market
  • Internal and external proprietary databases, key market indicators, and relevant press releases for  market estimates and forecasts



•       Top executives of end-use industries

•       C-level executives of the leading Parenteral Nutrition companies

•       Sales manager and regional sales manager of the Parenteral Nutrition companies

•       Industry Consultants

•       Distributors/Suppliers


•       Annual Reports

•       Presentations

•       Company Websites

•       Press Releases

•       News Articles

•       Government Agencies’ Publications

•       Industry Publications

•       Paid Databases


Analyst Tools and Models:



·         Arriving at
Global Market Size

·         Arriving at
Market Size

·         Market Share
of Key Players

·         Key Market Players

·         Key Market Players

·         Market Share
of Key Players

·         Arriving at
Market Size

·         Arriving at
Global Market Size


Artificial Intelligence in Drug Discovery and Development Market Dynamic Factors


  • Accelerated drug discovery process through the use of AI algorithms and machine learning, leading to the identification of potential drug candidates more efficiently.
  • AI enables personalized medicine by analyzing patient data and tailoring treatments based on individual characteristics, improving treatment outcomes.
  • Reduction in drug development costs and time due to AI-driven virtual screening and optimization, attracting pharmaceutical companies to adopt AI technologies.
  • AI's ability to handle big data and integrate diverse datasets enhances data mining and analysis, providing valuable insights for drug development.


  • Data privacy and security concerns hinder the widespread adoption of AI in drug discovery, especially when dealing with sensitive patient data.
  • Integration of AI into existing drug development workflows may pose challenges in terms of implementation and the need for specialized expertise.
  • Regulatory considerations and compliance with evolving AI guidelines present obstacles to the adoption of AI in drug development processes.


  • Collaborations between AI technology providers and pharmaceutical companies open opportunities for advanced AI-powered drug discovery solutions.
  • Advancements in AI algorithms and computing power offer potential for more accurate predictions and analysis in drug development.
  • AI-based drug repurposing efforts present opportunities for identifying new therapeutic uses for existing drugs, potentially reducing development costs.


  • Limited availability of high-quality data, especially in rare diseases, can hinder the effectiveness of AI models and drug discovery efforts.
  • Ethical considerations related to AI's decision-making capabilities in drug development, including accountability and transparency, require careful attention.
  • Validation and reproducibility of AI-generated results in drug discovery pose challenges in ensuring the reliability of AI-driven predictions.

Frequently Asked Questions

The global Artificial Intelligence in Drug Discovery and Development Market size was valued at USD 1.10 billion in 2022 and is projected to expand at a compound annual growth rate (CAGR) of 30.2% during the forecast period, reaching a value of USD 13.98 billion by 2030.

The need for faster and more efficient drug development processes, advancements in AI technologies like machine learning and natural language processing, and the potential to reduce drug development costs and increase success rates.

The integration of AI in target identification, drug design, and clinical trial optimization, as well as the use of AI for drug repurposing and personalized medicine.

The regions or countries expected to dominate the Artificial Intelligence in Drug Discovery and Development market are not specified in the provided information. The dominance of specific regions may vary based on market developments and regional adoption of AI technologies.

The data privacy and security concerns, regulatory considerations, and the validation and reproducibility of AI-generated results. Opportunities lie in collaborations between AI technology providers and pharmaceutical companies, advancements in AI algorithms, and potential drug repurposing efforts.
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