Explore the Potential with AI-Driven Innovation
The specialised, focused library is developed on demand with the most recent virtual screening and parameter assessment technology, guided by the Receptor.AI drug discovery platform. This approach exceeds the capabilities of traditional methods and offers compounds with higher 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 effective modulators, each annotated with 38 ADME-Tox and 32 physicochemical and drug-likeness parameters. Furthermore, each compound is shown with its optimal docking poses, affinity scores, and activity scores, offering a detailed summary.
Our top-notch dedicated system is used to design specialised 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
P25815
UPID:
S100P_HUMAN
Alternative names:
Migration-inducing gene 9 protein; Protein S100-E; S100 calcium-binding protein P
Alternative UPACC:
P25815; Q5J7W2
Background:
Protein S100-P, also known as Migration-inducing gene 9 protein, Protein S100-E, and S100 calcium-binding protein P, plays a pivotal role in cellular processes. It acts as a calcium sensor, contributing to cellular calcium signaling and interacting with proteins like EZR and PPP5C. This interaction is crucial for physiological processes such as microvilli formation in epithelial cells and may also stimulate cell proliferation via RAGE activation.
Therapeutic significance:
Understanding the role of Protein S100-P could open doors to potential therapeutic strategies.