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.
The library includes a list of the most promising modulators annotated with 38 ADME-Tox and 32 physicochemical and drug-likeness parameters. Also, each compound is presented with its optimal docking poses, affinity scores, and activity scores, providing a comprehensive overview.
We utilise our cutting-edge, exclusive workflow to develop focused libraries.
Fig. 1. The sreening workflow of Receptor.AI
Our methodology leverages molecular simulations to examine a vast array of proteins, capturing their dynamics in both isolated forms and in complexes with other proteins. Through ensemble virtual screening, we thoroughly account for the protein's conformational mobility, identifying critical binding sites within functional regions and distant allosteric locations. This detailed exploration ensures that we comprehensively assess every possible mechanism of action, with the objective of identifying novel therapeutic targets and lead compounds that span a wide spectrum of biological functions.
Key features that set our library apart include:
partner
Reaxense
upacc
O14782
UPID:
KIF3C_HUMAN
Alternative names:
-
Alternative UPACC:
O14782; O43544; Q4ZG18; Q53SX5; Q562F7
Background:
Kinesin-like protein KIF3C plays a pivotal role in cellular mechanics and intracellular transport. It is a microtubule-based anterograde translocator, essential for the movement of membranous organelles. This protein's intricate involvement in cellular transport mechanisms underscores its importance in maintaining cellular function and integrity.
Therapeutic significance:
Understanding the role of Kinesin-like protein KIF3C could open doors to potential therapeutic strategies. Its critical function in cellular transport and mechanics positions it as a key target for interventions in diseases where these processes are disrupted.