Explore the Potential with AI-Driven Innovation
Our detailed focused library is generated on demand with advanced virtual screening and parameter assessment technology powered by the Receptor.AI drug discovery platform. This method surpasses traditional approaches, delivering compounds of better quality with enhanced 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.
Contained in the library are leading modulators, each labelled with 38 ADME-Tox and 32 physicochemical and drug-likeness qualities. In addition, each compound is illustrated with its optimal docking poses, affinity scores, and activity scores, giving a complete picture.
We use our state-of-the-art dedicated workflow for designing focused libraries.
Fig. 1. The sreening workflow of Receptor.AI
Our strategy employs molecular simulations to explore an extensive range of proteins, capturing their dynamics both individually and within complexes with other proteins. Through ensemble virtual screening, we address proteins' conformational mobility, uncovering key binding sites at both functional regions and remote allosteric locations. This comprehensive investigation ensures a thorough assessment of all potential mechanisms of action, with the goal of discovering innovative therapeutic targets and lead molecules across across diverse biological functions.
Our library distinguishes itself through several key aspects:
partner
Reaxense
upacc
Q05940
UPID:
VMAT2_HUMAN
Alternative names:
Monoamine transporter; Solute carrier family 18 member 2; Vesicular amine transporter 2
Alternative UPACC:
Q05940; B2RC96; D3DRC4; Q15876; Q4G147; Q5VW49; Q9H3P6
Background:
The Synaptic vesicular amine transporter, also known as Solute carrier family 18 member 2 or Vesicular amine transporter 2, plays a crucial role in the nervous system. It functions as an electrogenic antiporter, facilitating the exchange of cationic monoamines with intravesicular protons. This process is vital for the accumulation of monoamines like dopamine, adrenaline, and serotonin inside vesicles, setting the stage for their release through exocytosis.
Therapeutic significance:
Given its pivotal role in monoamine transport, the Synaptic vesicular amine transporter is directly linked to Parkinsonism-dystonia 2, infantile-onset, a disorder marked by abnormal movements and autonomic dysfunction. Targeting this transporter could offer novel therapeutic avenues for managing this and potentially other neurodegenerative diseases.