Explore the Potential with AI-Driven Innovation
This extensive focused library is tailor-made using the latest virtual screening and parameter assessment technology, operated by the Receptor.AI drug discovery platform. This technique is more effective than traditional methods, offering compounds with improved 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.
The library includes a list of the most promising modulators annotated with 38 ADME-Tox and 32 physicochemical and drug-likeness parameters. Also, each compound is presented with its optimal 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
It includes comprehensive molecular simulations of the catalytic and allosteric binding pockets and the ensemble virtual screening accounting for their conformational mobility. In the case of designing modulators, the structural changes induced by reaction intermediates are taken into account to leverage activity and selectivity.
Our library is unique due to several crucial aspects:
partner
Reaxense
upacc
Q96EM0
UPID:
T3HPD_HUMAN
Alternative names:
Trans-L-3-hydroxyproline dehydratase
Alternative UPACC:
Q96EM0; Q96LJ5
Background:
Trans-3-hydroxy-L-proline dehydratase, also known as Trans-L-3-hydroxyproline dehydratase, plays a crucial role in the metabolism of trans-3-hydroxy-L-proline, a component found in the diet and in the degradation of collagen-IV. This enzyme catalyzes the dehydration of trans-3-hydroxy-L-proline to Delta(1)-pyrroline-2-carboxylate (Pyr2C), a key step in the degradation process.
Therapeutic significance:
Understanding the role of Trans-3-hydroxy-L-proline dehydratase could open doors to potential therapeutic strategies. Its involvement in the metabolism of components from the diet and collagen degradation highlights its importance in physiological processes.