Focused On-demand Libraries - Receptor.AI Collaboration


Explore the Potential with AI-Driven Innovation

The focused library is created on demand with the latest virtual screening and parameter assessment technology, supported by the Receptor.AI drug discovery platform. This method is more effective than traditional methods and results in higher-quality compounds with better 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 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 screening 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:


  • Receptor.AI compiles all relevant data on the target protein, such as past experimental results, literature findings, known ligands, and structural data, thereby enhancing the likelihood of focusing on the most significant compounds.

  • By utilizing advanced molecular simulations, the platform is adept at locating potential binding sites, rendering the compounds in the focused library well-suited for unearthing allosteric inhibitors and binders for hidden pockets.

  • The platform is supported by more than 50 highly specialized AI models, all of which have been rigorously tested and validated in diverse drug discovery and research programs. Its design emphasizes efficiency, reliability, and accuracy, crucial for producing focused libraries.

  • Receptor.AI extends beyond just creating focused libraries; it offers a complete spectrum of services and solutions during the preclinical drug discovery phase, with a success-dependent pricing strategy that reduces risk and fosters shared success in the project.


PARTNER
Receptor.AI
 
UPACC
O00442

UPID:
RTCA_HUMAN

ALTERNATIVE NAMES:
RNA terminal phosphate cyclase domain-containing protein 1

ALTERNATIVE UPACC:
O00442; Q5VVL5; Q5VVL6; Q96E99

BACKGROUND:
The enzyme RNA terminal phosphate cyclase domain-containing protein 1 is pivotal in RNA metabolism, facilitating the transformation of RNA's 3'-phosphate into a cyclic phosphodiester. This biochemical process is essential for the maturation and functionality of RNA molecules, underscoring the enzyme's significance in cellular operations.

THERAPEUTIC SIGNIFICANCE:
Exploring the functions of RNA terminal phosphate cyclase domain-containing protein 1 holds the potential to unlock new therapeutic approaches. Given its critical role in RNA processing, this enzyme represents a valuable target for drug discovery, aiming to modulate RNA-related diseases.

Looking for more information on this library or underlying technology? Fill out the form below and we will be in touch with all the details you need.