Machine Learning-Driven Enzyme Mining: Opportunities, Challenges, and Future Perspectives

Felix Moorhoff, Yanzi Zhang, Sizhe Qiu, Wenjuan Dong, David Medina-Ortiz, Jing Bo Zhao, Mehdi D. Davari

ACS Catalysis 2025 article cited by 35

importance 6/10 ai assisted Machine Learning in Bioinformatics enzyme discovery stage: research

Finding useful enzymes with desired functions among vast numbers of uncharacterized proteins is slow and difficult.

Biocatalysts underpin medicine and industry, so slow discovery limits new applications.

Machine learning models enable high-throughput prediction of enzyme functions (EC numbers, GO terms, substrate specificity) and catalytic properties such as kinetics, optimal temperature and pH.

not stated in source

ML is accelerating enzyme discovery, but data scarcity, generalizability and interpretability limits remain.

Venue ACS Catalysis
Published 2025
Work type article
Authors Felix Moorhoff, Yanzi Zhang, Sizhe Qiu, Wenjuan Dong, David Medina-Ortiz, Jing Bo Zhao, Mehdi D. Davari
Citations 35 (OpenAlex, at import time)
References 180
Model or method not stated in source
Organization not stated in source
Primary source https://doi.org/10.1021/acscatal.5c04814
Open access hybrid
Keywords machine learning, enzyme mining, biocatalysis, protein function prediction
6 / 10

significant — thousands to millions affected

Enzyme discovery spans biotechnology, biocatalysis, and synthetic biology; abstract claims ML accelerates discovery but gives no scale, metrics, or quantified impact.

Basis: inferred. Judged from the source text, which gives no explicit scale. Stated scale: not stated in source. Method and limits.

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