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.
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.
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.
Key features that set our library apart include:
partner
Reaxense
upacc
Q8NEB9
UPID:
PK3C3_HUMAN
Alternative names:
Phosphatidylinositol 3-kinase p100 subunit; Phosphoinositide-3-kinase class 3; hVps34
Alternative UPACC:
Q8NEB9; Q15134
Background:
Phosphatidylinositol 3-kinase catalytic subunit type 3 (PI3KC3), also known as hVps34, plays a pivotal role in cellular processes such as autophagy, endocytosis, and cytokinesis. It is a catalytic subunit of the PI3K complex, crucial for the formation of phosphatidylinositol 3-phosphate. PI3KC3 is involved in various membrane trafficking pathways, including the initiation of autophagosomes with PI3KC3-C1 and the maturation of autophagosomes and endocytosis as part of PI3KC3-C2.
Therapeutic significance:
Understanding the role of Phosphatidylinositol 3-kinase catalytic subunit type 3 could open doors to potential therapeutic strategies.