Explore the Potential with AI-Driven Innovation
The focused library is created on demand with the latest virtual screening and parameter assessment technology, supported by the Receptor.AI drug discovery platform. This method is more effective than traditional methods and results in higher-quality compounds with better 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
Our methodology employs molecular simulations to explore a wide array of proteins, capturing their dynamic states both individually and within complexes. Through ensemble virtual screening, we address conformational mobility, uncovering binding sites within functional regions and remote allosteric locations. This thorough exploration ensures no potential mechanism of action is overlooked, aiming to discover novel therapeutic targets and lead compounds across an extensive spectrum of biological functions.
Our library distinguishes itself through several key aspects:
partner
Reaxense
upacc
Q15555
UPID:
MARE2_HUMAN
Alternative names:
APC-binding protein EB2; End-binding protein 2
Alternative UPACC:
Q15555; B2RE21; B3KR39; B4DJV4; B7Z2L3; E9PHR3; F5H1V8; G5E9I6; Q9UQ33
Background:
Microtubule-associated protein RP/EB family member 2, also known as APC-binding protein EB2 and End-binding protein 2, plays a crucial role in microtubule polymerization and spindle function. It stabilizes microtubules and anchors them at centrosomes, which is essential for cell migration. This protein's involvement in these fundamental cellular processes underscores its importance in maintaining cellular integrity and function.
Therapeutic significance:
The protein is linked to the disease 'Skin creases, congenital symmetric circumferential, 2', characterized by multiple skin folds and intellectual disability. Understanding the role of Microtubule-associated protein RP/EB family member 2 could open doors to potential therapeutic strategies for this and related conditions.