QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL6082

This dataset contains QSAR data (from ChEMBL version 17) showing activity values (unit is pseudo-pCI50) of several compounds on drug target ChEMBL_ID: CHEMBL6082 (TID: 101433), and it has 81 rows and 43 features (not including molecule IDs and class feature: molecule_id and pXC50). The features represent Basic Molecular Descriptors which were generated from SMILES strings. Missing value imputation was applied to this dataset (By choosing the Median).

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，收录了多个化合物针对药物靶点ChEMBL_ID: CHEMBL6082（TID：101433）的活性值，其单位为伪pCI50。该数据集共包含81条样本与43个特征，不包含分子ID特征molecule_id与类别特征pXC50。所涉特征均为基于SMILES字符串生成的基础分子描述符（Basic Molecular Descriptors）。本数据集已通过中位数法完成缺失值填充。