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.
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 includes a list of the most effective modulators, each annotated with 38 ADME-Tox and 32 physicochemical and drug-likeness parameters. Furthermore, each compound is shown with its optimal docking poses, affinity scores, and activity scores, offering a detailed summary.
We utilise our cutting-edge, exclusive workflow to develop 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.
Our library is unique due to several crucial aspects:
partner
Reaxense
upacc
P49903
UPID:
SPS1_HUMAN
Alternative names:
Selenium donor protein 1; Selenophosphate synthase 1
Alternative UPACC:
P49903; B4DWK0; D3DRS9; D6PSQ9; Q5T5U8; Q5T5U9; Q9BVT4
Background:
Selenide, water dikinase 1, also known as Selenium donor protein 1 and Selenophosphate synthase 1, plays a crucial role in synthesizing selenophosphate from selenide and ATP. This enzyme is pivotal in the incorporation of selenium into selenoproteins, which are essential for various cellular processes.
Therapeutic significance:
Understanding the role of Selenide, water dikinase 1 could open doors to potential therapeutic strategies. Its critical function in selenoprotein synthesis suggests its importance in maintaining cellular health and preventing disease.