English

HyperSBINN: A Hypernetwork-Enhanced Systems Biology-Informed Neural Network for Efficient Drug Cardiosafety Assessment

Machine Learning 2025-12-15 v2 Computers and Society Machine Learning Quantitative Methods

Abstract

Mathematical modeling in systems toxicology enables a comprehensive understanding of the effects of pharmaceutical substances on cardiac health. However, the complexity of these models limits their widespread application in early drug discovery. In this paper, we introduce a novel approach to solving parameterized models of cardiac action potentials by combining meta-learning techniques with Systems Biology-Informed Neural Networks (SBINNs). The proposed method, hyperSBINN, effectively addresses the challenge of predicting the effects of various compounds at different concentrations on cardiac action potentials, outperforming traditional differential equation solvers in speed. Our model efficiently handles scenarios with limited data and complex parameterized differential equations. The hyperSBINN model demonstrates robust performance in predicting APD90 values, indicating its potential as a reliable tool for modeling cardiac electrophysiology and aiding in preclinical drug development. This framework represents an advancement in computational modeling, offering a scalable and efficient solution for simulating and understanding complex biological systems.

Keywords

Cite

@article{arxiv.2408.14266,
  title  = {HyperSBINN: A Hypernetwork-Enhanced Systems Biology-Informed Neural Network for Efficient Drug Cardiosafety Assessment},
  author = {Inass Soukarieh and Gerhard Hessler and Hervé Minoux and Marcel Mohr and Friedemann Schmidt and Jan Wenzel and Pierre Barbillon and Hugo Gangloff and Pierre Gloaguen},
  journal= {arXiv preprint arXiv:2408.14266},
  year   = {2025}
}