{ "data_id": "35483", "name": "QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL1865", "exact_name": "QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL1865", "version": 9, "version_label": null, "description": "This dataset contains QSAR data (from ChEMBL version 17) showing activity values (unit is pseudo-pCI50) of several compounds on drug target ChEMBL_ID: CHEMBL1865 (TID: 11307), and it has 864 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).", "format": "ARFF", "uploader": "Noureddin Sadawi", "uploader_id": 62, "visibility": "public", "creator": "\"Dr Jeremy Besnard, Dr Ivan Olier, Dr Noureddin Sadawi, Dr Larisa Soldatova, Dr Crina Grosan, Prof Ross King, Dr Richard Bickerton, Prof Andrew Hopkins and Dr Willem van Hoorn\"", "contributor": null, "date": "2016-07-15 18:09:58", "update_comment": null, "last_update": "2016-07-15 18:09:58", "licence": "Public", "status": "deactivated", "error_message": null, "url": "https:\/\/www.openml.org\/data\/download\/3559454\/data_33947.arff", "kaggle_url": null, "default_target_attribute": "pXC50", "row_id_attribute": "molecule_id", "ignore_attribute": null, "runs": 1, "suggest": { "input": [ "QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL1865", "This dataset contains QSAR data (from ChEMBL version 17) showing activity values (unit is pseudo-pCI50) of several compounds on drug target ChEMBL_ID: CHEMBL1865 (TID: 11307), and it has 864 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). " ], "weight": 5 }, "qualities": { "NumberOfInstances": 864, "NumberOfFeatures": 45, "NumberOfClasses": 0, "NumberOfMissingValues": 0, "NumberOfInstancesWithMissingValues": 0, "NumberOfNumericFeatures": 44, "NumberOfSymbolicFeatures": 1, "MaxSkewnessOfNumericAtts": 20.748410117872393, "MinStdDevOfNumericAtts": 0.018885946583902736, "Quartile1AttributeEntropy": null, "Quartile3SkewnessOfNumericAtts": 3.895805035931182, "MaxStdDevOfNumericAtts": 149.2149573082336, "MinorityClassPercentage": null, "Quartile1KurtosisOfNumericAtts": 1.6845605102931696, "Quartile3StdDevOfNumericAtts": 10.05619039503792, "MeanAttributeEntropy": null, "MinorityClassSize": null, "Quartile1MeansOfNumericAtts": 0.6731698495370367, "StdvNominalAttDistinctValues": null, "MeanKurtosisOfNumericAtts": 36.601674625289775, "NumberOfBinaryFeatures": 0, "Quartile1MutualInformation": null, "MeanMeansOfNumericAtts": 24.36225657617845, "Quartile1SkewnessOfNumericAtts": 0.8470249444787463, "MeanMutualInformation": null, 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