Focused On-demand Library for Marginal zone B- and B1-cell-specific protein

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.

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.

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

Fig. 1. The sreening workflow of Receptor.AI

Our strategy employs molecular simulations to explore an extensive range of proteins, capturing their dynamics both individually and within complexes with other proteins. Through ensemble virtual screening, we address proteins' conformational mobility, uncovering key binding sites at both functional regions and remote allosteric locations. This comprehensive investigation ensures a thorough assessment of all potential mechanisms of action, with the goal of discovering innovative therapeutic targets and lead molecules across across diverse biological functions.

Our library distinguishes itself through several key aspects:

The Receptor.AI platform integrates all available data about the target protein, including past experiments, literature data, known ligands, structural information and more. This consolidated approach maximises the probability of prioritising highly relevant compounds.
The platform uses sophisticated molecular simulations to identify possible binding sites so that the compounds in the focused library are suitable for discovering allosteric inhibitors and the binders for cryptic pockets.
The platform integrates over 50 highly customisable AI models, which are thoroughly tested and validated on a multitude of commercial drug discovery programs and research projects. It is designed to be efficient, reliable and accurate. All this power is utilised when producing the focused libraries.
In addition to producing the focused libraries, Receptor.AI provides services and end-to-end solutions at every stage of preclinical drug discovery. The pricing model is success-based, which reduces your risks and leverages the mutual benefits of the project's success.

partner

Reaxense

upacc

Q8WU39

UPID:

MZB1_HUMAN

Alternative names:

Mesenteric estrogen-dependent adipose 7; Plasma cell-induced resident endoplasmic reticulum protein; Proapoptotic caspase adapter protein

Alternative UPACC:

Q8WU39; D2IYS0; Q7Z6N2; Q96RL5; Q9P0T3

Background:

Marginal zone B- and B1-cell-specific protein, also known as Mesenteric estrogen-dependent adipose 7, Plasma cell-induced resident endoplasmic reticulum protein, and Proapoptotic caspase adapter protein, plays a crucial role in immunoglobulin M (IgM) assembly and secretion. It may function as a molecular chaperone or oxidoreductase, enhancing B-cell diversity by regulating Ca(2+) stores, antibody secretion, and integrin activation. Additionally, it acts as an adipokine/pro-inflammatory cytokine, influencing chronic inflammation and insulin response in adipocytes.

Therapeutic significance:

Understanding the role of Marginal zone B- and B1-cell-specific protein could open doors to potential therapeutic strategies.