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 carefully select specific compounds from a vast collection of over 60 billion molecules in virtual chemical space. Our partner Reaxense helps in synthesizing and delivering these compounds.
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
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
Q9Y4P9
UPID:
SPEF1_HUMAN
Alternative names:
-
Alternative UPACC:
Q9Y4P9; A5YM71; D3DVY0; Q5JX78
Background:
Sperm flagellar protein 1 plays a pivotal role in cell migration, microtubule stabilization, and ciliary function. It is essential for the bundling of microtubules, protecting them against depolymerization, and is crucial for the formation of the ciliary central apparatus. This protein also binds to actin in intestinal epithelial cells, supporting cell survival and aiding in cell motility by contributing to the formation of filopodia and lamellipodia.
Therapeutic significance:
Understanding the role of Sperm flagellar protein 1 could open doors to potential therapeutic strategies.