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.
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.
In the library, a selection of top modulators is provided, each marked with 38 ADME-Tox and 32 parameters related to physicochemical properties and drug-likeness. Also, every compound comes with its best docking poses, affinity scores, and activity scores, providing a comprehensive overview.
We use our state-of-the-art dedicated workflow for designing focused libraries.
Fig. 1. The sreening workflow of Receptor.AI
By deploying molecular simulations, our approach comprehensively covers a broad array of proteins, tracking their flexibility and dynamics individually and within complexes. Ensemble virtual screening is utilised to take into account conformational dynamics, identifying pivotal binding sites located within functional regions and at allosteric locations. This thorough exploration ensures that every conceivable mechanism of action is considered, aiming to identify new therapeutic targets and advance lead compounds throughout a vast spectrum of biological functions.
Our library stands out due to several important features:
partner
Reaxense
upacc
Q13424
UPID:
SNTA1_HUMAN
Alternative names:
59 kDa dystrophin-associated protein A1 acidic component 1; Pro-TGF-alpha cytoplasmic domain-interacting protein 1; Syntrophin-1
Alternative UPACC:
Q13424; A8K7H9; B4DX40; E1P5N1; Q16438
Background:
Alpha-1-syntrophin, known for its alternative names such as 59 kDa dystrophin-associated protein A1 acidic component 1, plays a pivotal role in organizing the subcellular localization of various membrane proteins. It is instrumental in linking receptors to the actin cytoskeleton and the extracellular matrix through the dystrophin glycoprotein complex, crucial for synapse formation and neuromuscular synapse organization.
Therapeutic significance:
Alpha-1-syntrophin's involvement in Long QT syndrome 12, a heart disorder leading to sudden death, underscores its potential as a target for therapeutic intervention. Understanding its role could pave the way for innovative treatments for this and possibly other related cardiac conditions.