Explore the Potential with AI-Driven Innovation
This extensive focused library is tailor-made using the latest virtual screening and parameter assessment technology, operated by the Receptor.AI drug discovery platform. This technique is more effective than traditional methods, offering compounds with improved 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.
The library includes a list of the most effective modulators, each annotated with 38 ADME-Tox and 32 physicochemical and drug-likeness parameters. Furthermore, each compound is shown with its optimal docking poses, affinity scores, and activity scores, offering a detailed summary.
Our top-notch dedicated system is used to design specialised libraries for enzymes.
Fig. 1. The sreening workflow of Receptor.AI
The method includes detailed molecular simulations of the catalytic and allosteric binding pockets, along with ensemble virtual screening that considers their conformational flexibility. In the design of modulators, structural changes induced by reaction intermediates are taken into account to enhance activity and selectivity.
Our library distinguishes itself through several key aspects:
partner
Reaxense
upacc
Q9H993
UPID:
ARMT1_HUMAN
Alternative names:
Acidic residue methyltransferase 1; Protein-glutamate O-methyltransferase; Sugar phosphate phosphatase ARMT1
Alternative UPACC:
Q9H993; Q96FC6; Q9UFY5
Background:
Damage-control phosphatase ARMT1, also known as Acidic residue methyltransferase 1, Protein-glutamate O-methyltransferase, and Sugar phosphate phosphatase ARMT1, exhibits a unique enzymatic activity. It demonstrates phosphatase activity against substrates like fructose-1-phosphate and fructose-6-phosphate, suggesting a pivotal role in hexose phosphate metabolism. Additionally, ARMT1 has O-methyltransferase activity, capable of methylating glutamate residues on target proteins, including PCNA, which implicates it in the DNA damage response.
Therapeutic significance:
Understanding the role of Damage-control phosphatase ARMT1 could open doors to potential therapeutic strategies.