Agentic Drug Discovery, Grounded in Physics
What we do
Crowded IP. Free energy calculations. Small teams.
Three needs, one partner.
Patent intelligence
Agentic Patent Intelligence
140M+
0.994
20
patent pages in training corpus
molecule localization (mAP@50)
patent offices in benchmark
A patent is compressed chemical space. We decompress it into data you can check.
✓ What is disclosed: molecules, activities and SAR
✓ Is my molecule claimed: Markush scope check
✓ Every value linked back to its source page
Uni-FEP
FEP in the Age of Agents
1.10
82%
350+
kcal/mol median RMSE
systems < 1.5 kcal/mol
systems benchmarked
Free energies you can rank on, from small molecules to cyclic peptides.
✓ On par with or better than FEP+ on 11 of 16 targets
✓ Cyclic peptides, covalent ligands, protein mutations
✓ Water-Swap and Terminal-Flip sampling
Learn more →Computational services
Expert CADD, On Demand
150+
56
100+
R&D organizations served
projects delivered
pipelines supported
Our scientists run the computation. You make the decisions.
✓ Discovery: novel-scaffold hits
✓ Ranking: managed FEP as a service
✓ Expansion: structure-based SAR
Learn more →Built to enhance your existing workflow
In the browser, in our agent, in yours, or with our team.
News & Events
Explore the latest news and events from our team.
Ready to accelerate your program?
Our mission is to democratize computational drug discovery tools and empower researchers and organizations worldwide.