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.
We utilise our cutting-edge, exclusive workflow to develop focused libraries for receptors.
Fig. 1. The sreening workflow of Receptor.AI
It includes extensive molecular simulations of the receptor in its native membrane environment and the ensemble virtual screening accounting for its conformational mobility. In the case of dimeric or oligomeric receptors, the whole functional complex is modelled, and the tentative binding pockets are determined on and between the subunits to cover the whole spectrum of possible mechanisms of action.
Our library is unique due to several crucial aspects:
partner
Reaxense
upacc
P28223
UPID:
5HT2A_HUMAN
Alternative names:
Serotonin receptor 2A
Alternative UPACC:
P28223; B2RAC5; B4DZ79; F5GWE8; Q5T8C0
Background:
The 5-hydroxytryptamine receptor 2A, also known as the Serotonin receptor 2A, is a pivotal G-protein coupled receptor for serotonin and various psychoactive substances, including LSD and psilocybin. It plays a crucial role in modulating neural activity, perception, cognition, and mood by triggering signaling pathways that affect phospholipase C and calcium ion release.
Therapeutic significance:
Understanding the role of 5-hydroxytryptamine receptor 2A could open doors to potential therapeutic strategies, especially in the realm of mental health, by targeting its involvement in mood regulation and response to psychoactive substances.