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.
The compounds are cherry-picked from the vast virtual chemical space of over 60B molecules. The synthesis and delivery of compounds is facilitated 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.
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.
Key features that set our library apart include:
partner
Reaxense
upacc
Q9HC77
UPID:
CENPJ_HUMAN
Alternative names:
Centrosomal P4.1-associated protein; LAG-3-associated protein; LYST-interacting protein 1
Alternative UPACC:
Q9HC77; Q2KHM6; Q5JPD5; Q5T6R5; Q96KS5; Q9C067
Background:
Centromere protein J, also known as Centrosomal P4.1-associated protein, plays a pivotal role in cell division and centrosome function. It is crucial for centriole duplication, inhibiting microtubule nucleation from the centrosome, and regulating the growth of centriolar microtubules. This protein stabilizes centriolar microtubules, inhibits their polymerization, and is essential for centriole elongation and amplification.
Therapeutic significance:
Centromere protein J is linked to Microcephaly 6, primary, autosomal recessive, and Seckel syndrome 4, both of which involve significant neurological deficits and developmental issues. Understanding the role of Centromere protein J could open doors to potential therapeutic strategies for these conditions.