{ "data_id": "24533", "name": "QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL4438", "exact_name": "QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL4438", "version": 7, "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: CHEMBL4438 (TID: 12999), and it has 21 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": "2016-07-14 14:51:45", "update_comment": null, "last_update": "2016-07-14 14:51:45", "licence": "Public", "status": "deactivated", "error_message": null, "url": "https:\/\/www.openml.org\/data\/download\/3248010\/data_35423.arff", "default_target_attribute": "pXC50", "row_id_attribute": "molecule_id", "ignore_attribute": null, "runs": 1, "suggest": { "input": [ "QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL4438", "This dataset contains QSAR data (from ChEMBL version 17) showing activity values (unit is pseudo-pCI50) of several compounds on drug target ChEMBL_ID: CHEMBL4438 (TID: 12999), and it has 21 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": 21, "NumberOfFeatures": 45, "NumberOfClasses": 0, "NumberOfMissingValues": 0, "NumberOfInstancesWithMissingValues": 0, "NumberOfNumericFeatures": 44, "NumberOfSymbolicFeatures": 1, "MeanMeansOfNumericAtts": 41.74769264069264, "Quartile1SkewnessOfNumericAtts": -0.566594137676991, "AutoCorrelation": -0.016549999999999798, "MeanMutualInformation": null, "Quartile1StdDevOfNumericAtts": 0.21821789023599242, "ClassEntropy": null, "MeanNoiseToSignalRatio": null, "Quartile2AttributeEntropy": null, "Dimensionality": 2.142857142857143, "MeanNominalAttDistinctValues": null, "Quartile2KurtosisOfNumericAtts": -0.8859487581411165, "EquivalentNumberOfAtts": null, "MeanSkewnessOfNumericAtts": 0.5671424861043997, "Quartile2MeansOfNumericAtts": 6.9936428571428575, "MajorityClassPercentage": null, "MeanStdDevOfNumericAtts": 21.053145986174805, "Quartile2MutualInformation": null, "MajorityClassSize": null, "MinAttributeEntropy": null, 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