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.
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 top-notch dedicated system is used to design specialised libraries for enzymes.
Fig. 1. The sreening workflow of Receptor.AI
It includes comprehensive molecular simulations of the catalytic and allosteric binding pockets and the ensemble virtual screening accounting for their conformational mobility. In the case of designing modulators, the structural changes induced by reaction intermediates are taken into account to leverage activity and selectivity.
Our library is unique due to several crucial aspects:
partner
Reaxense
upacc
Q6PI48
UPID:
SYDM_HUMAN
Alternative names:
Aspartyl-tRNA synthetase
Alternative UPACC:
Q6PI48
Background:
Aspartate--tRNA ligase, mitochondrial, also known as Aspartyl-tRNA synthetase, plays a crucial role in protein synthesis by attaching aspartate to its corresponding tRNA. This enzyme is essential for mitochondrial function and cellular energy production.
Therapeutic significance:
The protein is linked to Leukoencephalopathy with brainstem and spinal cord involvement and lactate elevation, a disease characterized by cerebellar ataxia, spasticity, and cognitive deficits. Understanding the role of Aspartate--tRNA ligase, mitochondrial could open doors to potential therapeutic strategies.