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.
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 features a range of promising modulators, each detailed with 38 ADME-Tox and 32 physicochemical and drug-likeness parameters. Plus, each compound is presented with its ideal docking poses, affinity scores, and activity scores, ensuring a thorough insight.
We use our state-of-the-art dedicated workflow for designing focused libraries.
Fig. 1. The sreening workflow of Receptor.AI
Our methodology employs molecular simulations to explore a wide array of proteins, capturing their dynamic states both individually and within complexes. Through ensemble virtual screening, we address conformational mobility, uncovering binding sites within functional regions and remote allosteric locations. This thorough exploration ensures no potential mechanism of action is overlooked, aiming to discover novel therapeutic targets and lead compounds across an extensive spectrum of biological functions.
Several key aspects differentiate our library:
partner
Reaxense
upacc
O60884
UPID:
DNJA2_HUMAN
Alternative names:
Cell cycle progression restoration gene 3 protein; Dnj3; HIRA-interacting protein 4; Renal carcinoma antigen NY-REN-14
Alternative UPACC:
O60884; B2R7L7; O14711
Background:
DnaJ homolog subfamily A member 2, known by alternative names such as Cell cycle progression restoration gene 3 protein, Dnj3, HIRA-interacting protein 4, and Renal carcinoma antigen NY-REN-14, plays a crucial role as a co-chaperone of Hsc70. It is instrumental in stimulating ATP hydrolysis and facilitating the folding of unfolded proteins mediated by HSPA1A/B, as demonstrated in vitro studies.
Therapeutic significance:
Understanding the role of DnaJ homolog subfamily A member 2 could open doors to potential therapeutic strategies. Its involvement in protein folding and cellular stress responses highlights its potential as a target for drug discovery efforts aimed at treating diseases linked to protein misfolding and cellular stress.