首页> Journal of medicinal chemistry> Discovery of a First-in-Class Small-Molecule Ligand for WDR91 Using DNA-Encoded Chemical Library Selection Followed by Machine Learning.

Discovery of a First-in-Class Small-Molecule Ligand for WDR91 Using DNA-Encoded Chemical Library Selection Followed by Machine Learning.

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第一作者： Shabbir,Ahmad

第一单位： Structural Genomics Consortium, University of Toronto, Ontario M5G 1L7, Canada.

作者： Shabbir,Ahmad ^[1] ; Jin,Xu ^[2] ; Jianwen A,Feng ^[2] ; Ashley,Hutchinson ^[1] ; Hong,Zeng ^[1] ; Pegah,Ghiabi ^[1] ; Aiping,Dong ^[1] ; Paolo A,Centrella ^[3] ; Matthew A,Clark ^[3] ; Marie-Aude,Guié ^[3] ; John P,Guilinger ^[3] ; Anthony D,Keefe ^[3] ; Ying,Zhang ^[3] ; Thomas,Cerruti ^[4] ; John W,Cuozzo ^[4] ; Moritz,von Rechenberg ^[4] ; Albina,Bolotokova ^[1] ; Yanjun,Li ^[1] ; Peter,Loppnau ^[1] ; Alma,Seitova ^[1] ; Yen-Yen,Li ^[1] ; Vijayaratnam,Santhakumar ^[1] ; Peter J,Brown ^[5] ; Suzanne,Ackloo ^[1] ; Levon,Halabelian ^[6]

作者单位： Structural Genomics Consortium, University of Toronto, Ontario M5G 1L7, Canada. ^[1] Google Research, Mountain View, California 94043, United States. ^[2] X-Chem Inc., 100 Beaver Street, Waltham, Massachusetts 02435, United States. ^[3] Relay Therapeutics, 399 Binney Street, Cambridge, Massachusetts 02139, United States. ^[4] Eshelman School of Pharmacy, University of North Carolina at Chapel Hill, Chapel Hill, North Carolina 27599, United States. ^[5] Structural Genomics Consortium, University of Toronto, Ontario M5G 1L7, Canada.;Department of Pharmacology and Toxicology, University of Toronto, Toronto M5S 1A8, Ontario, Canada. ^[6]

医学主题词 DNA(DNA);基因文库(Gene Library);配体(Ligands);小分子化合物库(Small Molecule Libraries)

DOI 10.1021/acs.jmedchem.3c01471

PMID 37996079

发布时间 2024-03-01

基金项目

P30 GM124165/GM/NIGMS NIH HHS/United States S10 OD021527/OD/NIH HHS/United States

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