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 carefully select specific compounds from a vast collection of over 60 billion molecules in virtual chemical space. Our partner Reaxense helps in synthesizing and delivering these compounds.
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.
Our high-tech, dedicated method is applied to construct targeted 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.
Our library is unique due to several crucial aspects:
partner
Reaxense
upacc
Q9NP72
UPID:
RAB18_HUMAN
Alternative names:
-
Alternative UPACC:
Q9NP72; B3KMC7; B7Z333; D3DRW1; Q53FX8; Q56UN9; Q6FIH1
Background:
Ras-related protein Rab-18 plays a pivotal role in intracellular membrane trafficking, influencing the formation, movement, and fusion of transport vesicles. It is essential for the localization of ZFYVE1 to lipid droplets, facilitating endoplasmic reticulum-lipid droplet contacts, and is crucial for maintaining endoplasmic reticulum structure. Additionally, Rab-18 is involved in apical endocytosis/recycling and is key to eye and brain development and neurodegeneration.
Therapeutic significance:
Rab-18's involvement in Warburg Micro Syndrome 3, a rare genetic disorder characterized by severe developmental anomalies, underscores its therapeutic significance. Understanding Rab-18's function could lead to novel therapeutic strategies for this syndrome and potentially other neurodevelopmental disorders.