Explore the Potential with AI-Driven Innovation
The specialised, focused library is developed on demand with the most recent virtual screening and parameter assessment technology, guided by the Receptor.AI drug discovery platform. This approach exceeds the capabilities of traditional methods and offers compounds with higher 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.
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
This approach involves comprehensive molecular simulations of the catalytic and allosteric binding pockets and ensemble virtual screening that accounts for their conformational flexibility. In the case of designing modulators, the structural adjustments caused by reaction intermediates are considered to improve activity and selectivity.
Our library is unique due to several crucial aspects:
partner
Reaxense
upacc
P14555
UPID:
PA2GA_HUMAN
Alternative names:
GIIC sPLA2; Group IIA phospholipase A2; Non-pancreatic secretory phospholipase A2; Phosphatidylcholine 2-acylhydrolase 2A
Alternative UPACC:
P14555; A8K5I7; Q6DN24; Q6IBD9; Q9UCD2
Background:
Phospholipase A2, membrane associated (P14555), known as GIIC sPLA2, plays a pivotal role in host defense, inflammation, and tissue regeneration. It targets extracellular phospholipids, favoring phosphatidylethanolamines and phosphatidylglycerols, and is involved in lipid remodeling and generation of lipid mediators for pathogen clearance. Its bactericidal activity against Gram-positive bacteria and role in sterile inflammation highlight its importance in immune response.
Therapeutic significance:
Understanding the role of Phospholipase A2, membrane associated, could open doors to potential therapeutic strategies. Its involvement in lipid remodeling, immune response, and tissue regeneration presents a unique opportunity for developing treatments targeting inflammatory diseases and infections.