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inoue0426/README.md

Yoshitaka Inoue

Machine Learning for Therapeutic Intervention & Biological Dynamics

PhD Candidate · Computer Science, University of Minnesota
Predoctoral Fellow · National Library of Medicine, NIH

I develop machine-learning methods to understand how biological systems respond to interventions and translate those representations into better therapeutic predictions.

Academic Website  ·  Google Scholar  ·  Research Statement  ·  Email


Research at a glance

Research direction Focus
01 · Perturbation modeling Learn how drugs change cellular states and how these changes generalize across conditions.
02 · Therapeutic response prediction Transfer molecular representations from experimental systems to drug-response prediction.
03 · Evidence-aware ML Connect computational predictions with biological networks and literature to support interpretation.

Featured research

01 · PerturbRx

From single-cell perturbations to patient drug response

Learns drug- and dose-conditioned latent transitions from single-cell populations, then transfers these signals to patient-level treatment-response prediction.

Read the preprint →

02 · drGT

Interpretable drug response prediction with graph learning

Models drug–cell–gene relationships to predict sensitivity and investigate gene-level contributions.

Explore the code → · Example notebook

03 · DrugAgent

Multi-agent reasoning over biomedical evidence

Combines machine-learning scores, knowledge-graph signals, and literature retrieval to assess drug–target interactions with evidence-linked reasoning.

Code & documentation → · Paper

04 · OncoGraph

A provenance-aware oncology knowledge graph

Explore relationships among therapeutics, targets, diseases, and clinical studies while tracing the evidence behind each connection.

Live explorer → · Code


Additional resources

Repository Description
awesome-computational-biology Curated datasets, databases, software, and papers for computational biology.
research_ideas Research questions, hypotheses, and experimental directions.

Pinned Loading

  1. drGT drGT Public

    Interpretable drug response prediction with graph neural networks over drugs, cell lines, and genes.

    Jupyter Notebook 2 2

  2. DrugAgent DrugAgent Public

    Drug-target interaction evidence integration with machine learning, knowledge graphs, and retrieved biomedical literature.

    Python 1 1

  3. awesome-computational-biology awesome-computational-biology Public

    Awesome list of computational biology.

    Python 160 20

  4. OncoGraph OncoGraph Public

    Evidence-aware oncology knowledge graph connecting drugs, targets, diseases, and clinical trials with traceable provenance.

    Python

  5. research_toolbox research_toolbox Public

    Reusable Python utilities for computational biology, including molecular fingerprints, data processing, model evaluation, and visualization.

    Python