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.
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.
The library includes a list of the most promising modulators annotated with 38 ADME-Tox and 32 physicochemical and drug-likeness parameters. Also, each compound is presented with its optimal docking poses, affinity scores, and activity scores, providing a comprehensive overview.
We utilise our cutting-edge, exclusive workflow to develop focused libraries.
Fig. 1. The sreening workflow of Receptor.AI
Our methodology leverages molecular simulations to examine a vast array of proteins, capturing their dynamics in both isolated forms and in complexes with other proteins. Through ensemble virtual screening, we thoroughly account for the protein's conformational mobility, identifying critical binding sites within functional regions and distant allosteric locations. This detailed exploration ensures that we comprehensively assess every possible mechanism of action, with the objective of identifying novel therapeutic targets and lead compounds that span a wide spectrum of biological functions.
Our library is unique due to several crucial aspects:
partner
Reaxense
upacc
P10109
UPID:
ADX_HUMAN
Alternative names:
Adrenal ferredoxin; Ferredoxin-1; Hepatoredoxin
Alternative UPACC:
P10109; B0YJ14; Q53YD6
Background:
Adrenodoxin, mitochondrial, also known as adrenal ferredoxin, ferredoxin-1, or hepatoredoxin, is pivotal in steroid hormone synthesis. It facilitates the transfer of electrons from adrenodoxin reductase to CYP11A1, a key enzyme in cholesterol side-chain cleavage, essential for steroidogenesis. This protein operates by shuttling between enzymes rather than forming a ternary complex, showcasing a unique mechanism of action.
Therapeutic significance:
Understanding the role of Adrenodoxin, mitochondrial, could open doors to potential therapeutic strategies. Its critical function in steroid hormone biosynthesis highlights its potential as a target for disorders related to steroid hormone imbalance.