Explore the Potential with AI-Driven Innovation
This comprehensive focused library is produced on demand with state-of-the-art virtual screening and parameter assessment technology driven by Receptor.AI drug discovery platform. This approach outperforms traditional methods and provides higher-quality compounds with superior activity, selectivity and safety.
We pick out particular compounds from an extensive virtual database of more than 60 billion molecules. The preparation and shipment of these compounds are facilitated by our associate 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 is unique due to several crucial aspects:
partner
Reaxense
upacc
Q92481
UPID:
AP2B_HUMAN
Alternative names:
Activating enhancer-binding protein 2-beta
Alternative UPACC:
Q92481; Q5JYX6; Q9NQ63; Q9NU99; Q9UJI7; Q9Y214; Q9Y3K3
Background:
Transcription factor AP-2-beta, also known as Activating enhancer-binding protein 2-beta, plays a pivotal role in DNA-binding and transcription regulation. It is essential for eye, face, body wall, limb, and neural tube development. Moreover, it suppresses genes like MCAM/MUC18, C/EBP alpha, and MYC, highlighting its broad regulatory spectrum.
Therapeutic significance:
AP-2-beta's involvement in Char syndrome and Patent ductus arteriosus 2 underscores its clinical relevance. Understanding its role could pave the way for innovative treatments targeting these congenital disorders.