QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL1741180

This dataset contains QSAR data (from ChEMBL version 17) showing activity values (unit is pseudo-pCI50) of several compounds on drug target ChEMBL_ID: CHEMBL1741180 (TID: 103976), and it has 754 rows and 69 features (not including molecule IDs and class feature: molecule_id and pXC50). The features represent Molecular Descriptors which were generated from SMILES strings. Missing value imputation was applied to this dataset (By choosing the Median). Feature selection was also applied.本数据集包含来自ChEMBL第17版的定量构效关系（Quantitative Structure-Activity Relationship，QSAR）数据，展示了多种化合物针对药物靶点ChEMBL_ID: CHEMBL1741180（靶点ID：TID 103976）的活性值，活性值单位为伪pCI50。该数据集共包含754条记录与69个特征，不包含分子ID（molecule_id）与类别特征pXC50。此处特征均为由简化分子线性输入规范（Simplified Molecular Input Line Entry System，SMILES）字符串生成的分子描述符（Molecular Descriptors）。本数据集已采用中位数法完成缺失值填充，并执行了特征选择流程。