Knowing Your Molecule, is More Important Than You Think...

Learn About: Self-supervised learning of molecular representations from millions of tandem mass spectra using DreaMS...

🧬 Imagine Biotech | Know Your Molecule

Data-Driven Clarity. Optimized Molecules. Ahead of Time

👋 Who We Are

The world of drug development must evolve to keep pace with the growing need for speed, innovation, and efficiency. Imagine Biotech leads this transformation to de-risk private biotech investors by harnessing predictive simulations.

We combine cutting-edge computational modeling, AI-powered mass spectrometry, and technical due diligence to uncover what matters most:
✅ Stability
✅ Solubility
✅ Toxicity risk
✅ Drug-likeness
✅ Metabolic behavior

🔬 Core Technologies We Offer

⚛️ Quantum Solvation Modeling (SQD‑IEF‑PCM)

We simulate how your molecule behaves in a physiological, water-like environment — such as blood or cytosol — using advanced quantum methods.

Helps you understand:

  • Solubility and polarity

  • Stability in solution

  • Energy states and degradation risk

  • Early ADMET red flags

🤖 DreaMS: Self-Supervised AI for MS/MS Data

Built on 201 million tandem mass spectra, DreaMS is an AI that can analyze complex biological samples and identify molecular features without needing labeled data.

Helps you understand:

  • Structure of unknown or novel molecules

  • Presence of functional groups or rare elements (e.g., fluorine)

  • Spectral similarity and molecular clustering

  • Relationships to known drugs or metabolites

🧠 DreaMS Atlas – The World’s Largest Spectral Map

We leverage the DreaMS Atlas — a connected network of 201M+ spectra — to help scientists explore structural “neighborhoods” and uncover hidden analogs or patterns.

Helps you explore:

  • Spectral networks for biomarker discovery

  • Molecular relationships across diverse datasets

  • Untargeted metabolomics insights at scale

🧪 Technical Due Diligence & Molecular Analysis

Our scientists bring decades of expertise and toolsets (NMR, LC-MS, bioinformatics, metabolomics databases, etc.) to provide clear, early molecular evaluations.

Helps you answer:

  • What’s the likely mechanism of action?

  • Are there toxicity or formulation flags?

  • Is the molecule suitable for further investment?

  • Are off-target or stereochemical risks present?

🔍 Why It Matters

Many molecules fail in late stages due to issues that could have been predicted early — if the right data and modeling had been used. We help you:
✅ Avoid expensive dead ends
✅ Identify winners sooner
✅ Gain scientific clarity before capital commitment

📩 Want to Know Your Molecule?

Whether you’re refining your lead compound or evaluating a new opportunity, we help you dig deeper — faster.

Imagine Biotech
Where knowing your molecule changes everything.