Discovery of Novel Inhibitors Targeting the Menin-Mixed Lineage Leukemia Interface Using Pharmacophore- and Docking-Based Virtual Screening.
Yuan XuLiyan YueYulan WangJing XingZhifeng ChenZhe ShiRongfeng LiuYu-Chih LiuXiaomin LuoHualiang JiangKaixian ChenCheng LuoMingyue ZhengPublished in: J. Chem. Inf. Model. (2016)
Keyphrases
- drug discovery
- virtual screening
- binding sites
- scientific data
- discovery process
- chemical structures
- chemical compounds
- gene expression
- knowledge discovery
- user interface
- early stage
- data mining
- microarray data
- gene expression data
- dna sequences
- systems biology
- metadata
- hiv protease
- similarity searching
- biological systems
- sequence data
- graphical models
- statistical significance
- similarity search
- data management
- nearest neighbor
- databases