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.
The compounds are cherry-picked from the vast virtual chemical space of over 60B molecules. The synthesis and delivery of compounds is facilitated by our partner Reaxense.
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 employ our advanced, specialised process to create targeted 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 stands out due to several important features:
partner
Reaxense
upacc
Q6UWW0
UPID:
LCN15_HUMAN
Alternative names:
-
Alternative UPACC:
Q6UWW0
Background:
Lipocalin-15, encoded by the gene with the accession number Q6UWW0, belongs to the lipocalin family, a group of proteins known for their ability to bind small hydrophobic molecules. These proteins play crucial roles in various biological processes, including transport of molecules, immune responses, and regulation of cell homeostasis.
Therapeutic significance:
Understanding the role of Lipocalin-15 could open doors to potential therapeutic strategies. Its involvement in the transport of hydrophobic molecules suggests a potential for targeting in conditions where regulation of these molecules is compromised.