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.
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.
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.
We employ our advanced, specialised process to create targeted libraries.
Fig. 1. The sreening workflow of Receptor.AI
Our strategy employs molecular simulations to explore an extensive range of proteins, capturing their dynamics both individually and within complexes with other proteins. Through ensemble virtual screening, we address proteins' conformational mobility, uncovering key binding sites at both functional regions and remote allosteric locations. This comprehensive investigation ensures a thorough assessment of all potential mechanisms of action, with the goal of discovering innovative therapeutic targets and lead molecules across across diverse biological functions.
Our library is unique due to several crucial aspects:
partner
Reaxense
upacc
Q9UKY0
UPID:
PRND_HUMAN
Alternative names:
PrPLP; Prion protein 2
Alternative UPACC:
Q9UKY0; A7U7M5; Q9H311; Q9H312; Q9NTM4
Background:
The Prion-like protein doppel, also known as PrPLP or Prion protein 2, plays a crucial role in male fertility, particularly in the acrosome reaction, a vital process for sperm to penetrate the egg. This protein's ability to bind copper ions (Cu(2+)) suggests its involvement in crucial biochemical pathways.
Therapeutic significance:
Understanding the role of Prion-like protein doppel could open doors to potential therapeutic strategies, especially in the realm of reproductive health and fertility treatments. Its unique function and biochemical interactions present a promising avenue for innovative therapeutic approaches.