Explore the Potential with AI-Driven Innovation
The focused library is created on demand with the latest virtual screening and parameter assessment technology, supported by the Receptor.AI drug discovery platform. This method is more effective than traditional methods and results in higher-quality compounds with better activity, selectivity, and safety.
From a virtual chemical space containing more than 60 billion molecules, we precisely choose certain compounds. Our collaborator, Reaxense, aids in their synthesis and provision.
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 use our state-of-the-art dedicated workflow for designing 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.
Our library stands out due to several important features:
partner
Reaxense
upacc
Q8TED1
UPID:
GPX8_HUMAN
Alternative names:
-
Alternative UPACC:
Q8TED1
Background:
Probable glutathione peroxidase 8 plays a crucial role in protecting cells from oxidative damage by catalyzing the reduction of hydrogen peroxide, lipid peroxides, and organic hydroperoxide by glutathione. This enzyme is part of a family of glutathione peroxidases, which are critical for cellular antioxidant defenses.
Therapeutic significance:
Understanding the role of Probable glutathione peroxidase 8 could open doors to potential therapeutic strategies. Its function in cellular protection against oxidative stress suggests its involvement in diseases where oxidative damage is a key factor, offering a promising target for therapeutic intervention.