Director, Predictive and Agentic Target Biology
GSK
Summary
As a Director-level individual contributor in Discovery Data Sciences (DDS), you will be a predictive engine for target discovery, bringing cutting-edge machine learning and agentic AI to the breadth of discovery data so that DDS can move beyond analysis toward prediction. This is a fully hands-on technical role: you will personally design, build and ship the agentic workflows.
Job description
Responsibilities
- Take pre-trained biological foundation models and adapt them to target biology questions with scientific rigour, fine-tuning, probing, and applying models (e.g. transcriptomic, high-content imaging) to questions such as target-disease mechanism.
- Apply and evaluate virtual-cell and in-silico perturbation approaches to predict cellular response and support mechanistic, in-silico target discovery.
- Integrate heterogeneous target evidence (omics, functional genomics, causal biology, chemogenomics, literature, clinical) into structured, traceable representations, applying knowledge-graph and graph-learning methods.
- Design and build agentic scientific workflows that plan, retrieve, analyse, and synthesise across the target discovery process, using current orchestration patterns (multi-agent systems, RAG, MCP-based tool access) with grounding, provenance, and rigorous evaluation of agent reliability.
- Evaluate emerging AI/ML approaches for discovery data science, benchmark their performance with appropriate validation strategies, and implement them into reliable, production use.
- Apply biological and chemical domain knowledge to ensure models are scientifically grounded, interpretable, and address meaningful therapeutic questions.
- Partner with scientific domain experts to ensure predictive and agentic methods address the questions that matter most to the portfolio.
- Contribute to the MLOps practices that bring predictive methods into reliable use, including model deployment, monitoring, and drift detection for robust model serving.
Basic Qualifications
- Master's degree (or higher) in Computer Science, Computational Biology, Bioinformatics, or a related field.
- 15+ years of software engineering and applied computational science experience in bioinformatics, cheminformatics, or scientific computing.
- Experience in pharmaceutical, biomedical, or life sciences preclinical discovery data.
- Experience applying machine learning, graph-based, or AI agent methods to biological or chemical data.
- Experience programming in Python and/or R, including machine learning libraries such as scikit-learn, PyTorch, or scverse.
- Experience with production AI/ML systems and MLOps practices (CI/CD, containerisation, cloud deployment).
Preferred Qualifications
- Fine-tuning or applying biological foundation models to target biology questions.
- Virtual-cell, in-silico perturbation, or perturbation-prediction methods, with an understanding of how to validate their reliability.
- Building or deploying agentic workflows (multi-agent orchestration, RAG, MCP-based tool access, foundation-model integration).
- An instinct for matching the right method to the scientific question, and for what makes a prediction credible enough to act on.
- Knowledge-graph or graph-learning methods for integrating heterogeneous evidence.
- Productionising ML models, model monitoring, and automated retraining; hands-on MLOps (versioning, experiment tracking, containerisation).
- Deep-learning architectures for biological data (transformers, diffusion models, GNNs), and data engineering concepts (ETL, databases, data lakes).
- Strong communication skills, with the ability to translate between biological and technical audiences.
Requirements
- Master's degree (or higher) in Computer Science, Computational Biology, Bioinformatics, or a related field
- 15+ years of software engineering and applied computational science experience in bioinformatics, cheminformatics, or scientific computing
- Experience in pharmaceutical, biomedical, or life sciences preclinical discovery data
- Experience applying machine learning, graph-based, or AI agent methods to biological or chemical data
- Experience programming in Python and/or R, including machine learning libraries such as scikit-learn, PyTorch, or scverse
- Experience with production AI/ML systems and MLOps practices (CI/CD, containerisation, cloud deployment)
Benefits
- Health Insurance
- Comprehensive Benefits Program
Company overview
GSK plc (formerly GlaxoSmithKline) is a British multinational pharmaceutical and biotechnology company headquartered in London, England. Founded in 2000 through the merger of Glaxo Wellcome and SmithKline Beecham, GSK has grown to become one of the world's leading healthcare companies with operations in over 150 countries. The company specializes in researching, developing, and manufacturing prescription medicines, vaccines, and consumer healthcare products. GSK's therapeutic areas include respiratory diseases, HIV/AIDS, oncology, immunology, and infectious diseases. The company is particularly renowned for its vaccine portfolio and has been at the forefront of developing treatments for major global health challenges. With approximately 70,000 employees worldwide, GSK maintains a strong commitment to scientific innovation and has a significant presence in key markets including the United States, Europe, and emerging economies. The company's mission is to unite science, technology, and talent to get ahead of disease together, aiming to positively impact the health of 2.5 billion people by the end of the decade.