AI-ACCELERATED DRUG DISCOVERY

Focused On-demand Library for Upstream stimulatory factor 1

Available from Reaxense
Predicted by Alphafold

Focused On-demand Libraries - Reaxense Collaboration

Explore the Potential with AI-Driven Innovation

This extensive focused library is tailor-made using the latest virtual screening and parameter assessment technology, operated by the Receptor.AI drug discovery platform. This technique is more effective than traditional methods, offering compounds with improved activity, selectivity, and safety.

The compounds are cherry-picked from the vast virtual chemical space of over 60B molecules. The synthesis and delivery of compounds is facilitated by our partner Reaxense.

Contained in the library are leading modulators, each labelled with 38 ADME-Tox and 32 physicochemical and drug-likeness qualities. In addition, each compound is illustrated with its optimal docking poses, affinity scores, and activity scores, giving a complete picture.

Our high-tech, dedicated method is applied to construct targeted libraries.

 Fig. 1. The sreening workflow of Receptor.AI

By deploying molecular simulations, our approach comprehensively covers a broad array of proteins, tracking their flexibility and dynamics individually and within complexes. Ensemble virtual screening is utilised to take into account conformational dynamics, identifying pivotal binding sites located within functional regions and at allosteric locations. This thorough exploration ensures that every conceivable mechanism of action is considered, aiming to identify new therapeutic targets and advance lead compounds throughout a vast spectrum of biological functions.

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

P22415

UPID:

USF1_HUMAN

Alternative names:

Class B basic helix-loop-helix protein 11; Major late transcription factor 1

Alternative UPACC:

P22415; B2RBZ4; Q5SY46; Q7Z5Y1

Background:

Upstream stimulatory factor 1 (USF1), encoded by the gene P22415, is a transcription factor that binds to symmetrical DNA sequences known as E-boxes. This protein plays a crucial role in the regulation of various viral and cellular promoters. It is alternatively named Class B basic helix-loop-helix protein 11 or Major late transcription factor 1, highlighting its significance in transcriptional control.

Therapeutic significance:

USF1's involvement in familial combined hyperlipidemia, a disorder marked by elevated serum cholesterol and triglycerides, underscores its potential as a target for therapeutic intervention. Understanding the role of Upstream stimulatory factor 1 could open doors to potential therapeutic strategies.

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