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.
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.
In the library, a selection of top modulators is provided, each marked with 38 ADME-Tox and 32 parameters related to physicochemical properties and drug-likeness. Also, every compound comes with its best docking poses, affinity scores, and activity scores, providing a comprehensive overview.
Our top-notch dedicated system is used to design specialised 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 is unique due to several crucial aspects:
partner
Reaxense
upacc
Q96L46
UPID:
CPNS2_HUMAN
Alternative names:
Calcium-dependent protease small subunit 2
Alternative UPACC:
Q96L46; Q9BPV4
Background:
Calpain small subunit 2, also known as Calcium-dependent protease small subunit 2, plays a pivotal role in cellular processes through its calcium-regulated non-lysosomal thiol-protease activity. It is instrumental in the limited proteolysis of substrates that are crucial for cytoskeletal remodeling and signal transduction. This protein acts as a tissue-specific chaperone for its larger counterpart, aiding in its proper folding and functional activity.
Therapeutic significance:
Understanding the role of Calpain small subunit 2 could open doors to potential therapeutic strategies. Its involvement in cytoskeletal remodeling and signal transduction highlights its importance in cellular function and disease modulation.