Leimbacher, Markus; Zhang, Yixin; Mannocci, Luca; Stravs, Michael; Geppert, Tim; Scheuermann, Joerg; Schneider, Gisbert; Neri, Dario published the artcile< Discovery of Small-Molecule Interleukin-2 Inhibitors from a DNA-Encoded Chemical Library>, Category: piperidines, the main research area is DNA encoded chem library drug discovery protein ligand; interleukin 2 inhibitor DNA encoded chem library; tumor antigen carbonic anhydrase IX inhibitor DNA encoded library.
Libraries of chem. compounds individually coupled to encoding DNA tags (DNA-encoded chem. libraries) hold promise to facilitate exceptionally efficient ligand discovery. We constructed a high-quality DNA-encoded chem. library comprising 30 000 drug-like compounds; this was screened in 170 different affinity capture experiments High-throughput sequencing allowed the evaluation of 120 million DNA codes for a systematic anal. of selection strategies and statistically robust identification of binding mols. Selections performed against the tumor-associated antigen carbonic anhydrase IX (CA IX) and the pro-inflammatory cytokine interleukin-2 (IL-2) yielded potent inhibitors with exquisite target specificity. The binding mode of the revealed pharmacophore against IL-2 was confirmed by mol. docking. Our findings suggest that DNA-encoded chem. libraries allow the facile identification of drug-like ligands principally to any protein of choice, including mols. capable of disrupting high-affinity protein-protein interactions.
Chemistry – A European Journal published new progress about Affinity (affinity selection). 180181-05-9 belongs to class piperidines, and the molecular formula is C22H23NO4, Category: piperidines.
Referemce:
Piperidine – Wikipedia,
Piperidine | C5H11N – PubChem