De novo drug design

The AI Co-Scientist
for drug development.

Helixir generates novel hypotheses, runs them through a scientific harness of ML models and scientific tools, and returns novel candidates. We do everything up to the wet lab, and every claim traces back to its source.

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The co-scientist, live

Watch it generate
something new.

Pick a program and Helixir generates: new hypotheses, new candidates, new trial designs. Runs are red-teamed, reviewed and ranked, and come back as reviewable artifacts where every claim traces to its source. Methods differ by program.

Four Co-Scientists, plus supporting capabilities
Helixirhelixir.deepbioscientific.com/co-scientist/protein-designillustrative run
Design a high-affinity, developable binder for the PD-1 / PD-L1 interaction, with pH-dependent release in the tumour microenvironment.
Co-Scientist · plan·
1Map the interaction interface and hotspotsStructure
2Design pH-sensitive binding variantsGenerative
3Filter for developability and stabilityADMET
4Rank by affinity and pH-dependent releaseScoring
5Package top candidates for validationArtifact
Co-Scientist · result
#CandidateΔGKd (pH 7.4)ReleaseEvidenceProv.
1PD1L1-452−11.30.37 nM77×37
2PD1L1-309−10.80.52 nM46×29
3PD1L1-118−10.10.91 nM34×22
Traced to sourceView full report →
Ask a follow-up…
◆ Illustrative co-scientist run, not a verified result.
Scored on expression, stability, and immunogenicityEquivariant foundation model
The thesis

Helixir generates Biology

Most AI for biology retrieves and summarises what is already known. Helixir generates novel hypotheses and de novo designs, produced by a scientific harness (first of its kind) that runs ML models and scientific tools together, and backed by evidence you can audit.

How a run works

A generative program, not a literature search.

Generate

Invent novel hypotheses, molecules and plans across the search space, rather than retrieving what is already published.

Red-team

Adversarial agents attack each candidate for weaknesses and contradicting evidence.

Peer-review

Separate AI review agents score what survives. Disagreement is kept as signal.

Rank

Candidates are ordered by the weight of supporting evidence, not by the confidence of their phrasing.

Artifact

The run returns a reviewable, exportable artifact: a novel result with every claim traced to source.

What we make · de novo design

We design the molecule, not just the answer.

Give Helixir a target and it invents binders that do not exist yet, folds them, scores them on predicted affinity, stability and developability, and hands back the candidate as a structure you can turn. Not a literature summary. A molecule, with its evidence attached.

  • Novel sequences generated, then folded and ranked
  • Predicted properties shown with their limitations
  • Binding pocket and interface open to inspection
See a design run →
HelixirStructure viewerlive
pTM 0.89
N → C
drag to rotate · scroll to zoom
How we make it · the scientific harness

Novel, and still grounded.

Anything can generate a plausible molecule. Ours is driven by a harness that runs ML models and scientific tools over a graph of ninety-plus sources: genes, targets, assays, trials, structures. The graph is where a new idea is built from, and what it is checked against.

  • Ninety-plus integrated sources, evidence-typed
  • Negative and conflicting findings kept, not discarded
  • ML models and scientific tools driven together, not a single model
Look inside the graph →
HelixirKnowledge Graphlive
Drag nodes · hover to trace · scroll to zoom
What you get back

From open question to testable candidate.

Every run returns an artifact a scientist can argue with: the claim, the evidence for and against it, what it does not establish, and the next experiment worth running. We take a programme all the way to the wet lab.

HelixirClaim → evidence → next experimentExample trace · illustrative
Generated hypothesis · H-17
Evaluate IL-17A pathway inhibition in early-stage, treatment-naïve patients.
01Zhou, Q. et al. IL-17A drives pathogenic T-cell responses in early autoimmunity. Nat. Immunol.Supporting
02Liu, Y. et al. IL-17A blockade reduces disease activity in treatment-naïve patients. Ann. Rheum. Dis.Supporting
03Korn, T. et al. IL-17 and Th17 cells. Annu. Rev. Immunol.Reference
04Lubberts, E. The IL-23–IL-17 axis in inflammatory arthritis. Nat. Rev. Rheumatol.Supporting
05Merola, J. et al. Safety of IL-17A inhibitors in early disease: a pooled analysis. J. Invest. Dermatol.Cautioning
Two ways to work with us
Early access

Run your own programs

Early access for researchers and biotech teams. Bring a target or an open question and get reviewable, evidence-backed artifacts back.

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Custom programs

Partner on a pipeline

Custom design programs with pharma and biotech partners: higher-value engagements with milestone-based upside.

Talk to us →
Latest news

What we have shipped and published.

All news →

Need clarity?
We're happy to go deep.

Still have questions? Reach our team directly.

Talk to us

DeepBio Scientific builds Helixir, an AI co-scientist for drug development. It generates novel hypotheses and de novo designs, takes them through generation, red-teaming, peer review and ranking, and returns reviewable, evidence-backed artifacts. It covers everything up to the wet lab.

Most of them retrieve and summarise: they find what is already written and compress it. Helixir generates new hypotheses and new candidates, then red-teams what it generated and hands back the evidence and the disagreement along with the result. The test is whether the output is something nobody had written down yet, and whether you can audit how it got there.

Hypothesis discovery, de novo protein design, clinical trial design, literature review, conservation discovery, and structural homolog search, each returning an exportable artifact grounded in evidence.

Research and biotech/pharma teams adopting it for their own programs (via early access or custom design partnerships), and investors evaluating the thesis and the working product.

Explore the platform to see the co-scientist, the knowledge graph and the live instruments, or apply for early access and run your own programs.

Build with us · invest in us

De novo drug design, everything up to the wet lab.

Whether you run programs or back the teams that do, DeepBio Scientific is building the co-scientist that invents, and shows its work.