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.
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.
Our top-notch dedicated system is used to design specialised libraries for enzymes.
Fig. 1. The sreening workflow of Receptor.AI
The method includes detailed molecular simulations of the catalytic and allosteric binding pockets, along with ensemble virtual screening that considers their conformational flexibility. In the design of modulators, structural changes induced by reaction intermediates are taken into account to enhance activity and selectivity.
Our library is unique due to several crucial aspects:
partner
Reaxense
upacc
Q9UL54
UPID:
TAOK2_HUMAN
Alternative names:
Kinase from chicken homolog C; Prostate-derived sterile 20-like kinase 1; Thousand and one amino acid protein kinase 2
Alternative UPACC:
Q9UL54; A5PKY1; A7MCZ2; B2RN35; B7ZM88; O94957; Q6UW73; Q7LC09; Q9NSW2
Background:
Serine/threonine-protein kinase TAO2, also known as Kinase from chicken homolog C, Prostate-derived sterile 20-like kinase 1, and Thousand and one amino acid protein kinase 2, plays a pivotal role in various cellular processes. It is involved in membrane blebbing, apoptotic bodies formation, DNA damage response, and activates the MAPK14/p38 MAPK stress-activated MAPK cascade. TAO2 phosphorylates itself, MBP, activated MAPK8, MAP2K3, MAP2K6, and tubulins, influencing cell morphology and stability.
Therapeutic significance:
Understanding the role of Serine/threonine-protein kinase TAO2 could open doors to potential therapeutic strategies.