Overview
About Deep MedChem
AI-Powered Drug Discovery for Medicinal & Computational Chemists through our flagship CHEESE platform.
What We Offer
Our flagship CHEESE Molecular Search (Chemical Embeddings Search Engine) transforms virtual high-throughput screening (vHTS). It screens billions of compounds (Enamine REAL, Chemriya or your in-house library) in seconds, leveraging 3D electrostatics and 3D shape similarity to uncover drug-like scaffolds.
You can try it here: https://cheese-new.deepmedchem.com/
Preprint about the technology: https://chemrxiv.org/engage/chemrxiv/article-details/67250915f9980725cfcd1f6f
CHEESE Modeller is a tool for very fast training and predictions with predictive models for properties of molecules. CHEESE Modeller provides you with a intuitive UI to use existing and to train your own predictive models.
CHEESE Electrostatics takes the speeds up dramatically the estimation of ESP/RESP (electrostatic potential) while keeping the accuracy on-par with DFT methods. The tool is available online and we offer also version with full privacy mode.
Test ride it here: https://electrostatics.deepmedchem.com/
CHEESE Explorer builds on the extreme speed of our molecular similarity engine that allows for interactive exploration of the vast molecular spaces that have been inaccessible for detailed and interactive visualisation until now. Test ride it here: https://explorer.deepmedchem.com/
All our tools are available on our cloud and on premises (on customers' servers).
Detailed documentation is available: https://cheese-docs.deepmedchem.com/
Watch Our Webinars & Tutorials: Dive into AI-driven drug discovery with our expert-led series at https://www.youtube.com/@deepmedchem
Contact us at [email protected]
What We Offer
Our flagship CHEESE Molecular Search (Chemical Embeddings Search Engine) transforms virtual high-throughput screening (vHTS). It screens billions of compounds (Enamine REAL, Chemriya or your in-house library) in seconds, leveraging 3D electrostatics and 3D shape similarity to uncover drug-like scaffolds.
You can try it here: https://cheese-new.deepmedchem.com/
Preprint about the technology: https://chemrxiv.org/engage/chemrxiv/article-details/67250915f9980725cfcd1f6f
CHEESE Modeller is a tool for very fast training and predictions with predictive models for properties of molecules. CHEESE Modeller provides you with a intuitive UI to use existing and to train your own predictive models.
CHEESE Electrostatics takes the speeds up dramatically the estimation of ESP/RESP (electrostatic potential) while keeping the accuracy on-par with DFT methods. The tool is available online and we offer also version with full privacy mode.
Test ride it here: https://electrostatics.deepmedchem.com/
CHEESE Explorer builds on the extreme speed of our molecular similarity engine that allows for interactive exploration of the vast molecular spaces that have been inaccessible for detailed and interactive visualisation until now. Test ride it here: https://explorer.deepmedchem.com/
All our tools are available on our cloud and on premises (on customers' servers).
Detailed documentation is available: https://cheese-docs.deepmedchem.com/
Watch Our Webinars & Tutorials: Dive into AI-driven drug discovery with our expert-led series at https://www.youtube.com/@deepmedchem
Contact us at [email protected]