4.6 Review

Machine and deep learning approaches for cancer drug repurposing

Journal

SEMINARS IN CANCER BIOLOGY
Volume 68, Issue -, Pages 132-142

Publisher

ACADEMIC PRESS LTD- ELSEVIER SCIENCE LTD
DOI: 10.1016/j.semcancer.2019.12.011

Keywords

Drug repurposing; Drug discovery; Machine learning; Deep learning; Artificial intelligence

Categories

Funding

  1. NIH [U54HL127624, U24TR002278, U01LM012630]
  2. State of Florida Biomedical Research Program [9BC13]
  3. DOD [CA140882]
  4. CCSG [NIH-P30 CA051008]
  5. GUMC Computational Chemistry Shared Resources (CCSR)
  6. GUMC Lombardi Comprehensive Cancer Center

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In recent years, there has been exponential growth in knowledge of cancer initiation, progression, and metastasis, although challenges remain in cancer therapeutics. With the high cost of developing new drugs, repurposing existing medications has become an attractive option. Advances in computational modeling and machine learning have facilitated the discovery of new therapeutic targets and drug associations.
Knowledge of the underpinnings of cancer initiation, progression and metastasis has increased exponentially in recent years. Advanced omics coupled with machine learning and artificial intelligence (deep learning) methods have helped elucidate targets and pathways critical to those processes that may be amenable to pharmacologic modulation. However, the current anti-cancer therapeutic armamentarium continues to lag behind. As the cost of developing a new drug remains prohibitively expensive, repurposing of existing approved and investigational drugs is sought after given known safety profiles and reduction in the cost barrier. Notably, successes in oncologic drug repurposing have been infrequent. Computational in-silico strategies have been developed to aid in modeling biological processes to find new disease-relevant targets and discovering novel drug-target and drug-phenotype associations. Machine and deep learning methods have especially enabled leaps in those successes. This review will discuss these methods as they pertain to cancer biology as well as immunomodulation for drug repurposing opportunities in oncologic diseases.

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