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.
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 utilise our cutting-edge, exclusive workflow to develop focused libraries for enzymes.
Fig. 1. The sreening workflow of Receptor.AI
It includes comprehensive molecular simulations of the catalytic and allosteric binding pockets and the ensemble virtual screening accounting for their conformational mobility. In the case of designing modulators, the structural changes induced by reaction intermediates are taken into account to leverage activity and selectivity.
Our library stands out due to several important features:
partner
Reaxense
upacc
P07202
UPID:
PERT_HUMAN
Alternative names:
-
Alternative UPACC:
P07202; P09934; P09935; Q8IUL0; Q8NF94; Q8NF95; Q8NF96; Q8NF97; Q8TCI9
Background:
Thyroid peroxidase plays a pivotal role in thyroid hormone biosynthesis, catalyzing the iodination and coupling of hormonogenic tyrosines in thyroglobulin to produce T(3) and T(4). This enzyme's activity is essential for the synthesis of thyroid hormones, which are critical for metabolic regulation and development.
Therapeutic significance:
Mutations in the thyroid peroxidase gene lead to Thyroid dyshormonogenesis 2A, a disorder characterized by an inability to effectively synthesize thyroid hormones. This highlights the enzyme's crucial role in maintaining thyroid hormone levels and underscores the potential for targeted therapies to correct its function.