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.
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.
Several key aspects differentiate our library:
partner
Reaxense
upacc
Q8J025
UPID:
APCD1_HUMAN
Alternative names:
Adenomatosis polyposis coli down-regulated 1 protein
Alternative UPACC:
Q8J025; B4DUQ0; B4DZT0; Q71M25
Background:
Protein APCDD1, also known as Adenomatosis polyposis coli down-regulated 1 protein, plays a pivotal role in the negative regulation of the Wnt signaling pathway. This protein acts upstream of beta-catenin and may inhibit Wnt signaling through its interactions with Wnt and LRP proteins. Its involvement in colorectal tumorigenesis highlights its significance in cellular processes.
Therapeutic significance:
APCDD1's link to Hypotrichosis 1, a rare hereditary condition characterized by progressive hair loss, underscores its therapeutic potential. Understanding the role of Protein APCDD1 could open doors to potential therapeutic strategies for treating hair loss disorders and possibly colorectal cancer.