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.
The compounds are cherry-picked from the vast virtual chemical space of over 60B molecules. The synthesis and delivery of compounds is facilitated by our partner 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 high-tech, dedicated method is applied to construct targeted libraries.
Fig. 1. The sreening workflow of Receptor.AI
Utilising molecular simulations, our approach thoroughly examines a wide array of proteins, tracking their conformational changes individually and within complexes. Ensemble virtual screening enables us to address conformational flexibility, revealing essential binding sites at functional regions and allosteric locations. Our rigorous analysis guarantees that no potential mechanism of action is overlooked, aiming to uncover new therapeutic targets and lead compounds across diverse biological functions.
Key features that set our library apart include:
partner
Reaxense
upacc
Q86UC2
UPID:
RSPH3_HUMAN
Alternative names:
A-kinase anchor protein RSPH3; Radial spoke head-like protein 2
Alternative UPACC:
Q86UC2; Q96LQ5; Q96LX2; Q9BX75
Background:
Radial spoke head protein 3 homolog (RSPH3) is pivotal in the motility of sperm and cilia, functioning within axonemal radial spoke complexes. It acts as a scaffold for the cAMP-dependent protein kinase holoenzyme, integrating MAPK and PKA signaling pathways in cilia.
Therapeutic significance:
RSPH3's mutation leads to primary ciliary dyskinesia, 32, marked by chronic respiratory infections and bronchiectasis due to motile cilia abnormalities. Targeting RSPH3 could revolutionize treatments for respiratory diseases.