Job Title:
AI drug discovery lead
Company: Pattern Agentix
Location: Nagpur, Maharashtra
Created: 2026-01-01
Job Type: Full Time
Job Description:
Role: AI Drug Discovery LeadPattern is building a lean, AI-driven drug discovery engine. We are seeking a hands-on AI Lead to own all AI strategy and execution across the de novo drug discovery pipeline, working directly with a medicinal chemist who provides chemical constraints and final decision-making.ResponsibilitiesOwn the AI components of the full 9-step discovery pipeline, from target selection to docked, synthesis-ready molecules.Generate and refine protein structures and binding pockets (AlphaFold/OpenFold).Build and run generative and reinforcement-learning models for de novo molecule design.Implement docking, scoring, and ranking workflows to prioritize compounds.Translate chemist-defined constraints into model objectives and filters.Incorporate chemist feedback and experimental data into continuous model improvement.Maintain reproducible, automated ML pipelines.RequirementsMSc or PhD in Machine Learning, Computer Science, Computational Chemistry, or related field.2+ years hands-on experience building deep learning models.Strong Python and PyTorch (or equivalent) experience.Background in generative models and optimization (RL, diffusion, GNNs).Experience working with molecular or structural biology data.Why This RoleYou will own the AI engine at the core of Pattern’s platform, working in real time with a chemist to turn AI-generated designs into real compounds. This is a high-ownership role focused on execution, speed, and real-world impact—not academic research.