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.
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.
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
P54707
UPID:
AT12A_HUMAN
Alternative names:
HK alpha 2; Non-gastric H(+)/K(+) ATPase subunit alpha; Non-gastric Na(+)/K(+) ATPase subunit alpha; Proton pump; Sodium pump
Alternative UPACC:
P54707; Q13816; Q13817; Q16734; Q5W035; Q8N5U2
Background:
Potassium-transporting ATPase alpha chain 2, also known as HK alpha 2, plays a crucial role in maintaining electrolyte homeostasis. It functions as the catalytic subunit of H(+)/K(+) and/or Na(+)/K(+) ATPase pumps, facilitating the exchange of K(+) for Na(+) and/or H(+) ions across epithelial cell membranes. This protein is pivotal in K(+) ion absorption in the kidney and colon, and in airway epithelium, it regulates mucus viscosity and clearance through acidification.
Therapeutic significance:
Understanding the role of Potassium-transporting ATPase alpha chain 2 could open doors to potential therapeutic strategies.