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.
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 includes a list of the most effective modulators, each annotated with 38 ADME-Tox and 32 physicochemical and drug-likeness parameters. Furthermore, each compound is shown with its optimal docking poses, affinity scores, and activity scores, offering a detailed summary.
We utilise our cutting-edge, exclusive workflow to develop focused libraries.
Fig. 1. The sreening workflow of Receptor.AI
By deploying molecular simulations, our approach comprehensively covers a broad array of proteins, tracking their flexibility and dynamics individually and within complexes. Ensemble virtual screening is utilised to take into account conformational dynamics, identifying pivotal binding sites located within functional regions and at allosteric locations. This thorough exploration ensures that every conceivable mechanism of action is considered, aiming to identify new therapeutic targets and advance lead compounds throughout a vast spectrum of biological functions.
Our library is unique due to several crucial aspects:
partner
Reaxense
upacc
Q9BYE0
UPID:
HES7_HUMAN
Alternative names:
Class B basic helix-loop-helix protein 37; Hairy and enhancer of split 7; bHLH factor Hes7
Alternative UPACC:
Q9BYE0; F8VPC9
Background:
Transcription factor HES-7, known as Class B basic helix-loop-helix protein 37, plays a pivotal role in somite formation and segmentation. It acts as a transcriptional repressor, targeting N box- and E box-containing promoters, and is crucial in the presomitic mesoderm (PSM) for coordinated somite segmentation.
Therapeutic significance:
Linked to Spondylocostal dysostosis 4, an autosomal recessive condition characterized by skeletal anomalies, understanding the role of Transcription factor HES-7 could open doors to potential therapeutic strategies.