474779-62-9

Upstream product

• 89-51-0 Homophthalic acid 
• 459-04-1 4-Fluorophenylacetyl chloride 

Downstream Products

• 1036487-53-2 3-(4-fluorobenzyl)-1H-isochromene-1-thione 
• 1227265-78-2 C₁₆H₁₃FO₃ 
• 474779-48-1 3-(4-fluorobenzyl)isoquinolin-1(2H)-one 

Relevant academic research and scientific papers

Identification of novel urease inhibitors by high-throughput virtual and in vitro screening

Ureases are important in both agriculture and human health. Bacterial ureases are directly involved in many farm-field problems and pathological conditions. Here, we report a structure-based virtual screening of an in-house compound bank of about 6000 molecular entities by computational docking and binding free energy calculations followed by in vitro screening. Applied protocol leads to the identification of novel urease inhibitors, which can serve as starting points for structural optimization.

Isoquinolinone derivatives

Derivatives of isoquinolinone and dihydrolisoquinolinone, and related compounds, and their use as pharmaceuticals in the treatment of a disease by inhibition of the enzyme poly(ADP-ribose)polymerase (“PARP”) are disclosed.