Explore the Potential with AI-Driven Innovation
Our detailed focused library is generated on demand with advanced virtual screening and parameter assessment technology powered by the Receptor.AI drug discovery platform. This method surpasses traditional approaches, delivering compounds of better quality with enhanced activity, selectivity, and safety.
We pick out particular compounds from an extensive virtual database of more than 60 billion molecules. The preparation and shipment of these compounds are facilitated by our associate 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 high-tech, dedicated method is applied to construct targeted 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.
Our library is unique due to several crucial aspects:
partner
Reaxense
upacc
P32119
UPID:
PRDX2_HUMAN
Alternative names:
Natural killer cell-enhancing factor B; PRP; Thiol-specific antioxidant protein; Thioredoxin peroxidase 1; Thioredoxin-dependent peroxide reductase 1; Thioredoxin-dependent peroxiredoxin 2
Alternative UPACC:
P32119; A8K0C0; P31945; P32118; P35701; Q6FHG4; Q92763; Q9UC23
Background:
Peroxiredoxin-2, also known as Thiol-specific antioxidant protein, plays a crucial role in cellular defense mechanisms. It catalyzes the reduction of hydrogen peroxide and organic hydroperoxides, thereby protecting cells from oxidative stress. This protein is involved in various signaling cascades, including those of growth factors and tumor necrosis factor-alpha, by regulating intracellular H(2)O(2) levels.
Therapeutic significance:
Understanding the role of Peroxiredoxin-2 could open doors to potential therapeutic strategies. Its ability to detoxify peroxides and act as a sensor for hydrogen peroxide-mediated events positions it as a key player in the prevention of oxidative stress-related diseases.