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 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.
In the library, a selection of top modulators is provided, each marked with 38 ADME-Tox and 32 parameters related to physicochemical properties and drug-likeness. Also, every compound comes with its best 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 methodology leverages molecular simulations to examine a vast array of proteins, capturing their dynamics in both isolated forms and in complexes with other proteins. Through ensemble virtual screening, we thoroughly account for the protein's conformational mobility, identifying critical binding sites within functional regions and distant allosteric locations. This detailed exploration ensures that we comprehensively assess every possible mechanism of action, with the objective of identifying novel therapeutic targets and lead compounds that span a wide spectrum of biological functions.
Our library distinguishes itself through several key aspects:
partner
Reaxense
upacc
Q9Y547
UPID:
IFT25_HUMAN
Alternative names:
Heat shock protein beta-11; Placental protein 25
Alternative UPACC:
Q9Y547; A6NG57; D3DQ45; Q9Y684
Background:
Intraflagellar transport protein 25 homolog (IFT25) is a key component of the IFT complex B, crucial for sonic hedgehog (SHH) signaling. It facilitates the transport of SHH components, playing a pivotal role in the export of SMO and PTCH1 receptors and the accumulation of GLI2 at the ciliary tip. IFT25 is not essential for ciliary assembly but is vital in tissues with ciliated cells, such as the kidney and testis, and is indispensable for male fertility and sperm flagella formation.
Therapeutic significance:
Understanding the role of Intraflagellar transport protein 25 homolog could open doors to potential therapeutic strategies.