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PreprintCC BYbioRxiv

Accessing Enzyme Kinetic Data and Prediction Methods at Scale

12 more authors
  1. 1University of Galway

Abstract

Enzyme kinetic parameters inform metabolic models, yet experimental measurements are sparse. A growing body of work predicts them from protein and substrate features, but software fragmentation hinders adoption, so downstream tools lock into the most accessible method. We present OpenKinetics Predictor (at predictor.openkinetics.org), an open-source platform integrating thirteen methods in isolated environments behind one interface. The platform optionally reports similarity between query proteins and each method's training data to contextualise reliability. A common featurisation-prediction abstraction keeps it extensible, and independent parties, including original authors, contributed many methods. We pair it with a data portal (at data.openkinetics.org) that exposes CatLog, a curated kinetic dataset, with precomputed embeddings, predicted binding sites, and standardised splits. Both offer a web interface and an API, and the GECKO modelling toolbox already calls the predictor API. As a case study, we predict across an E. coli model and find inter-predictor agreement varies with metabolic context and data availability.

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BibTeX
@misc{alwer2026accessing,
  title = {{Accessing Enzyme Kinetic Data and Prediction Methods at Scale}},
  author = {S. Alwer and H. Escoffier and K. Taha and V. Boorla and H. Yu and S. Santra and Z. Wang and C. Egwu and A. Osinuga and S. Dey and V. S. Raghunath and F. Zare and J. McGoldrick and J.-N. Weder and E. Kerkhoven and X. Luo and C. D. Maranas and L. Zheng and U. Wittig and R. Chowdhury and R. Saha and N. Toepfer and T. Sauter and R. M. T. Fleming},
  howpublished = {bioRxiv},
  year = {2026},
  month = sep,
  doi = {10.64898/2026.09.25.751968},
  url = {https://www.biorxiv.org/content/10.64898/2026.09.25.751968v1},
  note = {CC BY},
}
RIS
TY  - UNPB
TI  - Accessing Enzyme Kinetic Data and Prediction Methods at Scale
AU  - S. Alwer
AU  - H. Escoffier
AU  - K. Taha
AU  - V. Boorla
AU  - H. Yu
AU  - S. Santra
AU  - Z. Wang
AU  - C. Egwu
AU  - A. Osinuga
AU  - S. Dey
AU  - V. S. Raghunath
AU  - F. Zare
AU  - J. McGoldrick
AU  - J.-N. Weder
AU  - E. Kerkhoven
AU  - X. Luo
AU  - C. D. Maranas
AU  - L. Zheng
AU  - U. Wittig
AU  - R. Chowdhury
AU  - R. Saha
AU  - N. Toepfer
AU  - T. Sauter
AU  - R. M. T. Fleming
PY  - 2026
DA  - 2026/09/25
PB  - bioRxiv
DO  - 10.64898/2026.09.25.751968
UR  - https://www.biorxiv.org/content/10.64898/2026.09.25.751968v1
AB  - Enzyme kinetic parameters inform metabolic models, yet experimental measurements are sparse. A growing body of work predicts them from protein and substrate features, but software fragmentation hinders adoption, so downstream tools lock into the most accessible method. We present OpenKinetics Predictor (at predictor.openkinetics.org), an open-source platform integrating thirteen methods in isolated environments behind one interface. The platform optionally reports similarity between query proteins and each method's training data to contextualise reliability. A common featurisation-prediction abstraction keeps it extensible, and independent parties, including original authors, contributed many methods. We pair it with a data portal (at data.openkinetics.org) that exposes CatLog, a curated kinetic dataset, with precomputed embeddings, predicted binding sites, and standardised splits. Both offer a web interface and an API, and the GECKO modelling toolbox already calls the predictor API. As a case study, we predict across an E. coli model and find inter-predictor agreement varies with metabolic context and data availability.
ER  -