Focused On-demand Library for Dolichyl-phosphate beta-glucosyltransferase

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.

We carefully select specific compounds from a vast collection of over 60 billion molecules in virtual chemical space. Our partner Reaxense helps in synthesizing and delivering these compounds.

The library features a range of promising modulators, each detailed with 38 ADME-Tox and 32 physicochemical and drug-likeness parameters. Plus, each compound is presented with its ideal docking poses, affinity scores, and activity scores, ensuring a thorough insight.

We utilise our cutting-edge, exclusive workflow to develop focused libraries for enzymes.

Fig. 1. The sreening workflow of Receptor.AI

It includes comprehensive molecular simulations of the catalytic and allosteric binding pockets and the ensemble virtual screening accounting for their conformational mobility. In the case of designing modulators, the structural changes induced by reaction intermediates are taken into account to leverage 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

Q9Y673

UPID:

ALG5_HUMAN

Alternative names:

Asparagine-linked glycosylation protein 5 homolog

Alternative UPACC:

Q9Y673; B4DR37; Q5TBA6

Background:

Dolichyl-phosphate beta-glucosyltransferase, also known as Asparagine-linked glycosylation protein 5 homolog, plays a crucial role in the assembly of lipid-linked oligosaccharides in kidney epithelial cells and protein N-glycosylation. It is essential for the glycosylation and maturation of polycystin-1 (PKD1), a protein implicated in the development of Polycystic Kidney Disease 7 (PKD7).

Therapeutic significance:

Given its pivotal role in the pathogenesis of Polycystic Kidney Disease 7, an autosomal dominant disorder leading to end-stage renal disease, Dolichyl-phosphate beta-glucosyltransferase represents a promising target for therapeutic intervention. Understanding its function could pave the way for novel treatments.