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.
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.
Contained in the library are leading modulators, each labelled with 38 ADME-Tox and 32 physicochemical and drug-likeness qualities. In addition, each compound is illustrated with its optimal docking poses, affinity scores, and activity scores, giving a complete picture.
Our top-notch dedicated system is used to design specialised 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 stands out due to several important features:
partner
Reaxense
upacc
Q16739
UPID:
CEGT_HUMAN
Alternative names:
GLCT-1; Glucosylceramide synthase; Glycosylceramide synthase; UDP-glucose ceramide glucosyltransferase; UDP-glucose:N-acylsphingosine D-glucosyltransferase
Alternative UPACC:
Q16739; Q5T258
Background:
Ceramide glucosyltransferase, known by alternative names such as GLCT-1, Glucosylceramide synthase, and UDP-glucose:N-acylsphingosine D-glucosyltransferase, plays a pivotal role in the glucosylceramide-based glycosphingolipid synthetic pathway. It catalyzes the transfer of glucose to ceramide, forming glucosylceramide, a core component of glycosphingolipids. These molecules are crucial for membrane trafficking, signal transduction, and various cellular processes including growth and differentiation.
Therapeutic significance:
Understanding the role of Ceramide glucosyltransferase could open doors to potential therapeutic strategies.