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.
Our selection of compounds is from a large virtual library of over 60 billion molecules. The production and distribution of these compounds are managed 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.
We use our state-of-the-art dedicated workflow for designing focused libraries for enzymes.
Fig. 1. The sreening workflow of Receptor.AI
The procedure entails thorough molecular simulations of the catalytic and allosteric binding pockets, accompanied by ensemble virtual screening that factors in their conformational flexibility. When developing modulators, the structural modifications brought about by reaction intermediates are factored in to optimize activity and selectivity.
Key features that set our library apart include:
partner
Reaxense
upacc
P54619
UPID:
AAKG1_HUMAN
Alternative names:
-
Alternative UPACC:
P54619; B4DDT7; Q8N7V9
Background:
The 5'-AMP-activated protein kinase subunit gamma-1 is a pivotal component of AMPK, a crucial energy sensor that modulates cellular energy metabolism. This protein responds to low ATP levels by activating energy production and inhibiting energy consumption, affecting processes like protein, carbohydrate, and lipid biosynthesis, as well as cell growth. It also plays a role in cellular polarity by affecting the actin cytoskeleton.
Therapeutic significance:
Understanding the role of 5'-AMP-activated protein kinase subunit gamma-1 could open doors to potential therapeutic strategies.