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.
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.
Our high-tech, dedicated method is applied to construct 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
P49715
UPID:
CEBPA_HUMAN
Alternative names:
-
Alternative UPACC:
P49715; A7LNP2; P78319; Q05CA4
Background:
CCAAT/enhancer-binding protein alpha (CEBPA) is a transcription factor pivotal in the regulation of cellular differentiation and proliferation, particularly in myeloid cells, adipocytes, and liver cells. It binds to specific DNA sequences, promoting the expression of genes involved in cell maturation and energy homeostasis. CEBPA's role is crucial in early embryogenesis, liver and lung development, and adipocyte differentiation.
Therapeutic significance:
Given its critical function in the differentiation of myeloid progenitors and its involvement in acute myelogenous leukemia (AML), CEBPA presents a promising target for therapeutic intervention. Understanding the role of CEBPA could open doors to potential therapeutic strategies in treating AML by correcting the differentiation process of hematopoietic precursors.