AI-ACCELERATED DRUG DISCOVERY

Focused On-demand Library for Glycosylphosphatidylinositol-anchored high density lipoprotein-binding protein 1

Available from Reaxense
Predicted by Alphafold

Focused On-demand Libraries - Reaxense Collaboration

Explore the Potential with AI-Driven Innovation

The specialised, focused library is developed on demand with the most recent virtual screening and parameter assessment technology, guided by the Receptor.AI drug discovery platform. This approach exceeds the capabilities of traditional methods and offers compounds with higher 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 in-depth molecular simulations of both the catalytic and allosteric binding pockets, with ensemble virtual screening focusing on their conformational flexibility. For modulators, the process includes considering the structural shifts due to reaction intermediates to boost activity and selectivity.

Our library is unique due to several crucial aspects:

  • Receptor.AI compiles all relevant data on the target protein, such as past experimental results, literature findings, known ligands, and structural data, thereby enhancing the likelihood of focusing on the most significant compounds.
  • By utilizing advanced molecular simulations, the platform is adept at locating potential binding sites, rendering the compounds in the focused library well-suited for unearthing allosteric inhibitors and binders for hidden pockets.
  • The platform is supported by more than 50 highly specialized AI models, all of which have been rigorously tested and validated in diverse drug discovery and research programs. Its design emphasizes efficiency, reliability, and accuracy, crucial for producing focused libraries.
  • Receptor.AI extends beyond just creating focused libraries; it offers a complete spectrum of services and solutions during the preclinical drug discovery phase, with a success-dependent pricing strategy that reduces risk and fosters shared success in the project.

partner

Reaxense

upacc

Q8IV16

UPID:

HDBP1_HUMAN

Alternative names:

High density lipoprotein-binding protein 1

Alternative UPACC:

Q8IV16; Q6P3T2; Q86W15

Background:

Glycosylphosphatidylinositol-anchored high density lipoprotein-binding protein 1, also known as High density lipoprotein-binding protein 1, plays a pivotal role in lipid metabolism. It facilitates the transport and anchoring of lipoprotein lipase (LPL) on endothelial cells, crucial for lipolytic processing of chylomicrons, triglyceride metabolism, and overall lipid homeostasis. This protein also interacts with chylomicrons, phospholipid particles containing APOA5, and high-density lipoprotein (HDL), influencing lipid uptake from HDL.

Therapeutic significance:

Hyperlipoproteinemia 1D, a disorder marked by hyperlipoproteinemia, decreased plasma LPL levels, high plasma triglyceride levels, and refractory fasting chylomicronemia, is associated with variants affecting this protein. Understanding the role of Glycosylphosphatidylinositol-anchored high density lipoprotein-binding protein 1 could open doors to potential therapeutic strategies for lipid metabolism disorders.

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