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.
Our selection of compounds is from a large virtual library of over 60 billion molecules. The production and distribution of these compounds are managed by our partner Reaxense.
Contained in the library are leading modulators, each labelled with 38 ADME-Tox and 32 physicochemical and drug-likeness qualities. In addition, each compound is illustrated with its optimal docking poses, affinity scores, and activity scores, giving a complete picture.
Our high-tech, dedicated method is applied to construct 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.
Key features that set our library apart include:
partner
Reaxense
upacc
P54652
UPID:
HSP72_HUMAN
Alternative names:
-
Alternative UPACC:
P54652; Q15508; Q53XM3; Q9UE78
Background:
Heat shock-related 70 kDa protein 2 plays a crucial role in cellular processes, including stress response, protein folding, and degradation of misfolded proteins. It operates through ATP binding and hydrolysis, facilitating cycles of substrate binding and release. This protein is essential in maintaining protein quality control and is involved in spermatogenesis and spindle integrity during meiosis in male germ cells.
Therapeutic significance:
Understanding the role of Heat shock-related 70 kDa protein 2 could open doors to potential therapeutic strategies.