# ExPath: Targeted Pathway Inference for Biological Knowledge Bases via Graph Learning and Explanation

arXiv: https://arxiv.org/abs/2502.18026 · HTML: https://mlsanity.com/paper/2502.18026/

## Key facts

- No citing papers in the map yet (data through 14 Oct 2026).
- Builds on 16 of its 54 references that are in the map.
- First posted on arXiv 25 Feb 2025.

## Builds on (most cited first, 16 of 16)

- [Semi-Supervised Classification with Graph Convolutional Networks](https://mlsanity.com/paper/1609.02907/) (2016)
- [Graph Attention Networks](https://mlsanity.com/paper/1710.10903/) (2017)
- [Inductive Representation Learning on Large Graphs](https://mlsanity.com/paper/1706.02216/) (2017)
- [Mamba: Linear-Time Sequence Modeling with Selective State Spaces](https://mlsanity.com/paper/2312.00752/) (2023)
- [How Powerful are Graph Neural Networks?](https://mlsanity.com/paper/1810.00826/) (2018)
- [Deep Inside Convolutional Networks: Visualising Image Classification Models and Saliency Maps](https://mlsanity.com/paper/1312.6034/) (2013)
- [Learning Important Features Through Propagating Activation Differences](https://mlsanity.com/paper/1704.02685/) (2017)
- [Striving for Simplicity: The All Convolutional Net](https://mlsanity.com/paper/1412.6806/) (2014)
- [GNNExplainer: Generating Explanations for Graph Neural Networks](https://mlsanity.com/paper/1903.03894/) (2019)
- [Recipe for a General, Powerful, Scalable Graph Transformer](https://mlsanity.com/paper/2205.12454/) (2022)
- [Parameterized Explainer for Graph Neural Network](https://mlsanity.com/paper/2011.04573/) (2020)
- [Graph-Mamba: Towards Long-Range Graph Sequence Modeling with Selective State Spaces](https://mlsanity.com/paper/2402.00789/) (2024)
- [Graph Embedding on Biomedical Networks: Methods, Applications, and Evaluations](https://mlsanity.com/paper/1906.05017/) (2019)
- [Walking Out of the Weisfeiler Leman Hierarchy: Graph Learning Beyond Message Passing](https://mlsanity.com/paper/2102.08786/) (2021)
- [Disease State Prediction From Single-Cell Data Using Graph Attention Networks](https://mlsanity.com/paper/2002.07128/) (2020)
- [GeSubNet: Gene Interaction Inference for Disease Subtype Network Generation](https://mlsanity.com/paper/2410.13178/) (2024)

## Abstract (arXiv)

Retrieving targeted pathways in biological knowledge bases, particularly when incorporating wet-lab experimental data, remains a challenging task and often requires downstream analyses and specialized expertise. In this paper, we frame this challenge as a solvable graph learning and explaining task and propose a novel subgraph inference framework, ExPAth, that explicitly integrates experimental data to classify various graphs (bio-networks) in biological databases. The links (representing pathways) that contribute more to classification can be considered as targeted pathways. Our framework can seamlessly integrate biological foundation models to encode the experimental molecular data. We propose ML-oriented biological evaluations and a new metric. The experiments involving 301 bio-networks evaluations demonstrate that pathways inferred by ExPath are biologically meaningful, achieving up to 4.5x higher Fidelity+ (necessity) and 14x lower Fidelity- (sufficiency) than explainer baselines, while preserving signaling chains up to 4x longer.