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.
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.
The library includes a list of the most promising modulators annotated with 38 ADME-Tox and 32 physicochemical and drug-likeness parameters. Also, each compound is presented with its optimal docking poses, affinity scores, and activity scores, providing a comprehensive overview.
We employ our advanced, specialised process to create targeted libraries for enzymes.
Fig. 1. The sreening workflow of Receptor.AI
This approach involves comprehensive molecular simulations of the catalytic and allosteric binding pockets and ensemble virtual screening that accounts for their conformational flexibility. In the case of designing modulators, the structural adjustments caused by reaction intermediates are considered to improve activity and selectivity.
Our library stands out due to several important features:
partner
Reaxense
upacc
Q01433
UPID:
AMPD2_HUMAN
Alternative names:
AMP deaminase isoform L
Alternative UPACC:
Q01433; A0A5F9UK94; B4DK50; B4DZI5; E9PNG0; Q14856; Q14857; Q16686; Q16687; Q16688; Q16729; Q5T693; Q5T695; Q96IA1; Q9UDX8; Q9UDX9; Q9UMU4
Background:
AMP deaminase 2, also known as AMP deaminase isoform L, plays a pivotal role in energy metabolism by catalyzing the deamination of AMP to IMP. This process is crucial in the purine nucleotide cycle, highlighting the enzyme's importance in cellular energy homeostasis.
Therapeutic significance:
The enzyme's association with diseases such as Pontocerebellar hypoplasia 9 and Spastic paraplegia 63 underscores its potential as a therapeutic target. Understanding the role of AMP deaminase 2 could open doors to potential therapeutic strategies, offering hope for patients suffering from these debilitating conditions.