AI-ACCELERATED DRUG DISCOVERY

Focused On-demand Library for Transcription factor LBX1

Available from Reaxense
Predicted by Alphafold

Focused On-demand Libraries - Reaxense Collaboration

Explore the Potential with AI-Driven Innovation

This comprehensive focused library is produced on demand with state-of-the-art virtual screening and parameter assessment technology driven by Receptor.AI drug discovery platform. This approach outperforms traditional methods and provides higher-quality compounds with superior 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.

 Fig. 1. The sreening workflow of Receptor.AI

Our methodology employs molecular simulations to explore a wide array of proteins, capturing their dynamic states both individually and within complexes. Through ensemble virtual screening, we address conformational mobility, uncovering binding sites within functional regions and remote allosteric locations. This thorough exploration ensures no potential mechanism of action is overlooked, aiming to discover novel therapeutic targets and lead compounds across an extensive 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

P52954

UPID:

LBX1_HUMAN

Alternative names:

Ladybird homeobox protein homolog 1

Alternative UPACC:

P52954; B9EGA2; Q05BB2

Background:

Transcription factor LBX1, also known as Ladybird homeobox protein homolog 1, plays a crucial role in the development of GABAergic interneurons in the spinal cord and the migration and development of muscle precursor cells. This protein is essential for the formation of limb muscles, the diaphragm, and the hypoglossal cord.

Therapeutic significance:

LBX1's involvement in congenital central hypoventilation syndrome, specifically the neonatal form known as CCHS3, highlights its potential as a target for therapeutic intervention. Understanding the role of Transcription factor LBX1 could open doors to potential therapeutic strategies for respiratory insufficiency and related autonomic control disorders.

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