AI-ACCELERATED DRUG DISCOVERY

Focused On-demand Library for Exonuclease V

Available from Reaxense
Predicted by Alphafold

Focused On-demand Libraries - Reaxense Collaboration

Explore the Potential with AI-Driven Innovation

The focused library is created on demand with the latest virtual screening and parameter assessment technology, supported by the Receptor.AI drug discovery platform. This method is more effective than traditional methods and results in higher-quality compounds with better activity, selectivity, and safety.

Our selection of compounds is from a large virtual library of over 60 billion molecules. The production and distribution of these compounds are managed by our partner Reaxense.

The library includes a list of the most effective modulators, each annotated with 38 ADME-Tox and 32 physicochemical and drug-likeness parameters. Furthermore, each compound is shown with its optimal docking poses, affinity scores, and activity scores, offering a detailed summary.

Our top-notch dedicated system is used to design specialised libraries for enzymes.

 Fig. 1. The sreening workflow of Receptor.AI

The method includes detailed molecular simulations of the catalytic and allosteric binding pockets, along with ensemble virtual screening that considers their conformational flexibility. In the design of modulators, structural changes induced by reaction intermediates are taken into account to enhance activity and selectivity.

Key features that set our library apart include:

  • The Receptor.AI platform integrates extensive information about the target protein, such as historical experiments, academic research, known ligands, and structural insights, thereby increasing the likelihood of identifying highly relevant compounds.
  • The platform’s sophisticated molecular simulations are designed to discover potential binding sites, ensuring that our focused library is optimal for the discovery of allosteric inhibitors and binders for cryptic pockets.
  • With over 50 customisable AI models, verified through extensive testing in commercial drug discovery and research, Receptor.AI is efficient, reliable, and precise. These models are essential in the production of our focused libraries.
  • Receptor.AI not only produces focused libraries but also provides full services and solutions at every stage of preclinical drug discovery, with a success-based pricing structure that aligns our interests with the success of your project.

partner

Reaxense

upacc

Q9H790

UPID:

EXO5_HUMAN

Alternative names:

Defects in morphology protein 1 homolog

Alternative UPACC:

Q9H790; D3DPV4; Q5SWM7; Q5SWM8; Q5SWM9; Q5SWN0; Q5SWN1; Q8WTW9

Background:

Exonuclease V, also known as Defects in morphology protein 1 homolog, plays a crucial role in DNA repair mechanisms. It exhibits bidirectional exonuclease activity, primarily involved in repairing DNA damage caused by ultraviolet irradiation and interstrand cross-links. This protein uniquely combines both 5'-3' and 3'-5' exonuclease activities, favoring 5'-ends, and demonstrates a sliding exonuclease function that is pivotal for DNA repair processes.

Therapeutic significance:

Understanding the role of Exonuclease V could open doors to potential therapeutic strategies. Its involvement in DNA repair mechanisms highlights its significance in maintaining genomic stability, which is essential for preventing the onset of various diseases.

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