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.
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.
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
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.
Our library stands out due to several important features:
partner
Reaxense
upacc
P52198
UPID:
RND2_HUMAN
Alternative names:
Rho family GTPase 2; Rho-related GTP-binding protein Rho7; Rnd2
Alternative UPACC:
P52198; A8K2D4; O00690; O00734; Q5U0P6; Q99535
Background:
Rho-related GTP-binding protein RhoN, also known as Rho family GTPase 2, Rho7, and Rnd2, plays a crucial role in cellular processes. It is specifically involved in neuronal and hepatic functions, distinguishing itself as a C3 toxin-insensitive member of the Rho subfamily. This protein's unique characteristics and functions make it a significant subject of study in the field of cellular biology.
Therapeutic significance:
Understanding the role of Rho-related GTP-binding protein RhoN could open doors to potential therapeutic strategies. Its involvement in critical neuronal and hepatic functions highlights its potential as a target for drug discovery, aiming to address disorders related to these systems.