Explore the Potential with AI-Driven Innovation
This extensive focused library is tailor-made using the latest virtual screening and parameter assessment technology, operated by the Receptor.AI drug discovery platform. This technique is more effective than traditional methods, offering compounds with improved activity, selectivity, and safety.
We pick out particular compounds from an extensive virtual database of more than 60 billion molecules. The preparation and shipment of these compounds are facilitated by our associate Reaxense.
The library features a range of promising modulators, each detailed with 38 ADME-Tox and 32 physicochemical and drug-likeness parameters. Plus, each compound is presented with its ideal docking poses, affinity scores, and activity scores, ensuring a thorough insight.
We employ our advanced, specialised process to create targeted 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.
Our library distinguishes itself through several key aspects:
partner
Reaxense
upacc
Q9H270
UPID:
VPS11_HUMAN
Alternative names:
RING finger protein 108
Alternative UPACC:
Q9H270; Q8WY89; Q96EP8; Q9H6D9; Q9HCS6
Background:
Vacuolar protein sorting-associated protein 11 homolog, also known as RING finger protein 108, is crucial in vesicle-mediated protein trafficking to lysosomal compartments, including endocytic membrane transport and autophagic pathways. It acts as a core component of the HOPS and CORVET endosomal tethering complexes, facilitating the Rab5-to-Rab7 endosome conversion, essential for membrane fusion events.
Therapeutic significance:
This protein's malfunction is linked to Leukodystrophy, hypomyelinating, 12, and Dystonia 32, diseases characterized by neurologic disorders and dystonia, respectively. Understanding the role of Vacuolar protein sorting-associated protein 11 homolog could open doors to potential therapeutic strategies for these conditions.