Explore the Potential with AI-Driven Innovation
Our detailed focused library is generated on demand with advanced virtual screening and parameter assessment technology powered by the Receptor.AI drug discovery platform. This method surpasses traditional approaches, delivering compounds of better quality with enhanced 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.
The library includes a list of the most promising modulators annotated with 38 ADME-Tox and 32 physicochemical and drug-likeness parameters. Also, each compound is presented with its optimal docking poses, affinity scores, and activity scores, providing a comprehensive overview.
Our high-tech, dedicated method is applied to construct targeted 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
Q9H6U6
UPID:
BCAS3_HUMAN
Alternative names:
Breast carcinoma-amplified sequence 3; GAOB1
Alternative UPACC:
Q9H6U6; Q17RM0; Q6KF21; Q8IXI6; Q8NDR8; Q8TDL9; Q8TDM1; Q8WY55; Q9BVF0; Q9H957; Q9H9Y9; Q9NXP4
Background:
BCAS3, also known as Breast carcinoma-amplified sequence 3 or GAOB1, is a microtubule-associated cell migration factor. It plays a pivotal role in angiogenesis, cell polarity, and endothelial cell migration through the activation of CDC42 and reorganization of the actin cytoskeleton. BCAS3 also functions as a transcriptional coactivator of estrogen receptor-responsive genes and is involved in autophagic activity regulation.
Therapeutic significance:
The association of BCAS3 with Hengel-Maroofian-Schols syndrome, a disorder marked by developmental delays and neurological issues, underscores its clinical importance. Understanding the role of BCAS3 could open doors to potential therapeutic strategies for treating this syndrome and possibly other related conditions.