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.
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 utilise our cutting-edge, exclusive workflow to develop focused libraries for enzymes.
Fig. 1. The sreening workflow of Receptor.AI
It includes comprehensive molecular simulations of the catalytic and allosteric binding pockets and the ensemble virtual screening accounting for their conformational mobility. In the case of designing modulators, the structural changes induced by reaction intermediates are taken into account to leverage activity and selectivity.
Several key aspects differentiate our library:
partner
Reaxense
upacc
Q86V25
UPID:
VASH2_HUMAN
Alternative names:
Vasohibin-2; Vasohibin-like protein
Alternative UPACC:
Q86V25; B4DYZ5; Q2VT46; Q5VTE7; Q5VTE9; Q7Z6E3; Q8IZ24; Q9H9W5
Background:
Tubulinyl-Tyr carboxypeptidase 2, also known as Vasohibin-2 and Vasohibin-like protein, plays a pivotal role in cellular processes by regulating microtubule dynamics through the removal of the C-terminal tyrosine residue of alpha-tubulin. This action is crucial for spindle function and accurate chromosome segregation during mitosis, impacting mitotic spindle length and positioning. Additionally, it activates angiogenesis, particularly in infiltrating mononuclear cells at the sprouting front, and is involved in axon formation.
Therapeutic significance:
Understanding the role of Tubulinyl-Tyr carboxypeptidase 2 could open doors to potential therapeutic strategies.