{
    "data_id": "37751",
    "name": "QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL3285",
    "exact_name": "QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL3285",
    "version": 12,
    "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: CHEMBL3285 (TID: 11579), and it has 18 rows and 50 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.",
    "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": "2016-07-16 01:44:19",
    "update_comment": null,
    "last_update": "2016-07-16 01:44:19",
    "licence": "Public",
    "status": "deactivated",
    "error_message": null,
    "url": "https:\/\/www.openml.org\/data\/download\/3621076\/data_51020.arff",
    "default_target_attribute": "pXC50",
    "row_id_attribute": "molecule_id",
    "ignore_attribute": null,
    "runs": 2,
    "suggest": {
        "input": [
            "QSAR-DATASET-FOR-DRUG-TARGET-CHEMBL3285",
            "This dataset contains QSAR data (from ChEMBL version 17) showing activity values (unit is pseudo-pCI50) of several compounds on drug target ChEMBL_ID: CHEMBL3285 (TID: 11579), and it has 18 rows and 50 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. "
        ],
        "weight": 5
    },
    "qualities": {
        "NumberOfInstances": 18,
        "NumberOfFeatures": 52,
        "NumberOfClasses": 0,
        "NumberOfMissingValues": 0,
        "NumberOfInstancesWithMissingValues": 0,
        "NumberOfNumericFeatures": 51,
        "NumberOfSymbolicFeatures": 1,
        "ClassEntropy": null,
        "MeanNoiseToSignalRatio": null,
        "Quartile2AttributeEntropy": null,
        "Dimensionality": 2.888888888888889,
        "MeanNominalAttDistinctValues": null,
        "Quartile2KurtosisOfNumericAtts": -0.791375997661008,
        "EquivalentNumberOfAtts": null,
        "MeanSkewnessOfNumericAtts": -0.22252902154646936,
        "Quartile2MeansOfNumericAtts": 2.8401666666666667,
        "MajorityClassPercentage": null,
        "MeanStdDevOfNumericAtts": 0.7567622443726135,
        "Quartile2MutualInformation": null,
        "MajorityClassSize": null,
        "MinAttributeEntropy": null,
        "Quartile2SkewnessOfNumericAtts": -0.5856117136906596,
        "MaxAttributeEntropy": null,
        "MinKurtosisOfNumericAtts": -1.824163036015588,
        "PercentageOfBinaryFeatures": 0,
        "Quartile2StdDevOfNumericAtts": 0.3937140107009429,
        "MaxKurtosisOfNumericAtts": 17.999999999999993,
        "MinMeansOfNumericAtts": -1.2181666666666666,
        "PercentageOfInstancesWithMissingValues": 0,
        "Quartile3AttributeEntropy": null,
        "MaxMeansOfNumericAtts": 39.676833333333335,
        "MinMutualInformation": null,
        "PercentageOfMissingValues": 0,
        "Quartile3KurtosisOfNumericAtts": -0.3637081025390039,
        "MaxMutualInformation": null,
        "MinNominalAttDistinctValues": null,
        "PercentageOfNumericFeatures": 98.07692307692307,
        "Quartile3MeansOfNumericAtts": 4.025666666666667,
        "MaxNominalAttDistinctValues": null,
        "MinSkewnessOfNumericAtts": -1.8281056925829988,
        "PercentageOfSymbolicFeatures": 1.9230769230769231,
        "Quartile3MutualInformation": null,
        "MaxSkewnessOfNumericAtts": 4.242640687119286,
        "MinStdDevOfNumericAtts": 0.019090770449090556,
        "Quartile1AttributeEntropy": null,
        "Quartile3SkewnessOfNumericAtts": 0.4649295291949027,
        "MaxStdDevOfNumericAtts": 8.736884956052364,
        "MinorityClassPercentage": null,
        "Quartile1KurtosisOfNumericAtts": -1.14210331235267,
        "Quartile3StdDevOfNumericAtts": 0.6910893361847188,
        "MeanAttributeEntropy": null,
        "MinorityClassSize": null,
        "Quartile1MeansOfNumericAtts": 1.3762777777777777,
        "StdvNominalAttDistinctValues": null,
        "MeanKurtosisOfNumericAtts": -0.045688876332472934,
        "NumberOfBinaryFeatures": 0,
        "Quartile1MutualInformation": null,
        "MeanMeansOfNumericAtts": 3.639331154684096,
        "Quartile1SkewnessOfNumericAtts": -0.7753543084784247,
        "AutoCorrelation": 0.42494117647058827,
        "MeanMutualInformation": null,
        "Quartile1StdDevOfNumericAtts": 0.2848471726465016
    },
    "tags": [
        {
            "tag": "MetaQSAR",
            "uploader": "62"
        },
        {
            "tag": "study_13",
            "uploader": "62"
        }
    ],
    "features": [
        {
            "name": "pXC50",
            "index": "51",
            "type": "numeric",
            "distinct": "18",
            "missing": "0",
            "target": "1",
            "min": "4",
            "max": "6",
            "mean": "5",
            "stdev": "1"
        },
        {
            "name": "molecule_id",
            "index": "0",
            "type": "nominal",
            "distinct": "18",
            "missing": "0",
            "identifier": "1",
            "distr": []
        },
        {
            "name": "Eig09_AEA.bo.",
            "index": "1",
            "type": "numeric",
            "distinct": "12",
            "missing": "0",
            "min": "-1",
            "max": "0",
            "mean": "0",
            "stdev": "0"
        },
        {
            "name": "Eig09_AEA.dm.",
            "index": "2",
            "type": "numeric",
            "distinct": "14",
            "missing": "0",
            "min": "-2",
            "max": "0",
            "mean": "-1",
            "stdev": "1"
        },
        {
            "name": "Eig09_AEA.ri.",
            "index": "3",
            "type": "numeric",
            "distinct": "11",
            "missing": "0",
            "min": "-1",
            "max": "0",
            "mean": "0",
            "stdev": "0"
        },
        {
            "name": "Eig09_EA",
            "index": "4",
            "type": "numeric",
            "distinct": "11",
            "missing": "0",
            "min": "-2",
            "max": "0",
            "mean": "-1",
            "stdev": "1"
        },
        {
            "name": "Eig09_EA.ri.",
            "index": "5",
            "type": "numeric",
            "distinct": "12",
            "missing": "0",
            "min": "-2",
            "max": "0",
            "mean": "-1",
            "stdev": "1"
        },
        {
            "name": "JGI3",
            "index": "6",
            "type": "numeric",
            "distinct": "13",
            "missing": "0",
            "min": "0",
            "max": "0",
            "mean": "0",
            "stdev": "0"
        },
        {
            "name": "P_VSA_LogP_2",
            "index": "7",
            "type": "numeric",
            "distinct": "12",
            "missing": "0",
            "min": "16",
            "max": "33",
            "mean": "23",
            "stdev": "6"
        },
        {
            "name": "SM03_AEA.dm.",
            "index": "8",
            "type": "numeric",
            "distinct": "11",
            "missing": "0",
            "min": "-2",
            "max": "0",
            "mean": "-1",
            "stdev": "1"
        },
        {
            "name": "X4Av",
            "index": "9",
            "type": "numeric",
            "distinct": "16",
            "missing": "0",
            "min": "0",
            "max": "0",
            "mean": "0",
            "stdev": "0"
        },
        {
            "name": "Eig09_EA.bo.",
            "index": "10",
            "type": "numeric",
            "distinct": "13",
            "missing": "0",
            "min": "-2",
            "max": "0",
            "mean": "-1",
            "stdev": "1"
        },
        {
            "name": "AAC",
            "index": "11",
            "type": "numeric",
            "distinct": "14",
            "missing": "0",
            "min": "1",
            "max": "1",
            "mean": "1",
            "stdev": "0"
        },
        {
            "name": "AECC",
            "index": "12",
            "type": "numeric",
            "distinct": "15",
            "missing": "0",
            "min": "3",
            "max": "7",
            "mean": "5",
            "stdev": "1"
        },
        {
            "name": "ALOGP",
            "index": "13",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "0",
            "max": "3",
            "mean": "1",
            "stdev": "1"
        },
        {
            "name": "ALOGP2",
            "index": "14",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "0",
            "max": "7",
            "mean": "2",
            "stdev": "2"
        },
        {
            "name": "AMR",
            "index": "15",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "24",
            "max": "55",
            "mean": "40",
            "stdev": "9"
        },
        {
            "name": "AMW",
            "index": "16",
            "type": "numeric",
            "distinct": "14",
            "missing": "0",
            "min": "5",
            "max": "7",
            "mean": "6",
            "stdev": "0"
        },
        {
            "name": "ARR",
            "index": "17",
            "type": "numeric",
            "distinct": "2",
            "missing": "0",
            "min": "0",
            "max": "1",
            "mean": "0",
            "stdev": "0"
        },
        {
            "name": "ATS1e",
            "index": "18",
            "type": "numeric",
            "distinct": "15",
            "missing": "0",
            "min": "3",
            "max": "4",
            "mean": "3",
            "stdev": "0"
        },
        {
            "name": "ATS1i",
            "index": "19",
            "type": "numeric",
            "distinct": "15",
            "missing": "0",
            "min": "3",
            "max": "4",
            "mean": "3",
            "stdev": "0"
        },
        {
            "name": "ATS1m",
            "index": "20",
            "type": "numeric",
            "distinct": "15",
            "missing": "0",
            "min": "2",
            "max": "3",
            "mean": "3",
            "stdev": "0"
        },
        {
            "name": "ATS1p",
            "index": "21",
            "type": "numeric",
            "distinct": "14",
            "missing": "0",
            "min": "2",
            "max": "3",
            "mean": "3",
            "stdev": "0"
        },
        {
            "name": "ATS1s",
            "index": "22",
            "type": "numeric",
            "distinct": "15",
            "missing": "0",
            "min": "4",
            "max": "4",
            "mean": "4",
            "stdev": "0"
        },
        {
            "name": "ATS1v",
            "index": "23",
            "type": "numeric",
            "distinct": "15",
            "missing": "0",
            "min": "2",
            "max": "3",
            "mean": "3",
            "stdev": "0"
        },
        {
            "name": "ATS2e",
            "index": "24",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "3",
            "max": "4",
            "mean": "4",
            "stdev": "0"
        },
        {
            "name": "ATS2i",
            "index": "25",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "3",
            "max": "4",
            "mean": "4",
            "stdev": "0"
        },
        {
            "name": "ATS2m",
            "index": "26",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "2",
            "max": "3",
            "mean": "3",
            "stdev": "0"
        },
        {
            "name": "ATS2p",
            "index": "27",
            "type": "numeric",
            "distinct": "16",
            "missing": "0",
            "min": "2",
            "max": "3",
            "mean": "3",
            "stdev": "0"
        },
        {
            "name": "ATS2s",
            "index": "28",
            "type": "numeric",
            "distinct": "18",
            "missing": "0",
            "min": "4",
            "max": "5",
            "mean": "5",
            "stdev": "0"
        },
        {
            "name": "ATS2v",
            "index": "29",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "2",
            "max": "3",
            "mean": "3",
            "stdev": "0"
        },
        {
            "name": "ATS3e",
            "index": "30",
            "type": "numeric",
            "distinct": "18",
            "missing": "0",
            "min": "3",
            "max": "4",
            "mean": "4",
            "stdev": "0"
        },
        {
            "name": "ATS3i",
            "index": "31",
            "type": "numeric",
            "distinct": "18",
            "missing": "0",
            "min": "4",
            "max": "5",
            "mean": "4",
            "stdev": "0"
        },
        {
            "name": "ATS3m",
            "index": "32",
            "type": "numeric",
            "distinct": "18",
            "missing": "0",
            "min": "2",
            "max": "3",
            "mean": "3",
            "stdev": "0"
        },
        {
            "name": "ATS3p",
            "index": "33",
            "type": "numeric",
            "distinct": "16",
            "missing": "0",
            "min": "2",
            "max": "4",
            "mean": "3",
            "stdev": "0"
        },
        {
            "name": "ATS3s",
            "index": "34",
            "type": "numeric",
            "distinct": "18",
            "missing": "0",
            "min": "4",
            "max": "5",
            "mean": "5",
            "stdev": "0"
        },
        {
            "name": "ATS3v",
            "index": "35",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "2",
            "max": "3",
            "mean": "3",
            "stdev": "0"
        },
        {
            "name": "ATS4e",
            "index": "36",
            "type": "numeric",
            "distinct": "18",
            "missing": "0",
            "min": "3",
            "max": "4",
            "mean": "4",
            "stdev": "0"
        },
        {
            "name": "ATS4i",
            "index": "37",
            "type": "numeric",
            "distinct": "18",
            "missing": "0",
            "min": "4",
            "max": "5",
            "mean": "4",
            "stdev": "0"
        },
        {
            "name": "ATS4m",
            "index": "38",
            "type": "numeric",
            "distinct": "18",
            "missing": "0",
            "min": "2",
            "max": "3",
            "mean": "2",
            "stdev": "0"
        },
        {
            "name": "ATS4p",
            "index": "39",
            "type": "numeric",
            "distinct": "18",
            "missing": "0",
            "min": "2",
            "max": "3",
            "mean": "3",
            "stdev": "0"
        },
        {
            "name": "ATS4s",
            "index": "40",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "4",
            "max": "5",
            "mean": "5",
            "stdev": "0"
        },
        {
            "name": "ATS4v",
            "index": "41",
            "type": "numeric",
            "distinct": "18",
            "missing": "0",
            "min": "2",
            "max": "3",
            "mean": "3",
            "stdev": "0"
        },
        {
            "name": "ATS5e",
            "index": "42",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "3",
            "max": "4",
            "mean": "4",
            "stdev": "1"
        },
        {
            "name": "ATS5i",
            "index": "43",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "3",
            "max": "5",
            "mean": "4",
            "stdev": "1"
        },
        {
            "name": "ATS5m",
            "index": "44",
            "type": "numeric",
            "distinct": "15",
            "missing": "0",
            "min": "1",
            "max": "3",
            "mean": "2",
            "stdev": "1"
        },
        {
            "name": "ATS5p",
            "index": "45",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "1",
            "max": "3",
            "mean": "3",
            "stdev": "1"
        },
        {
            "name": "ATS5s",
            "index": "46",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "4",
            "max": "5",
            "mean": "5",
            "stdev": "0"
        },
        {
            "name": "ATS5v",
            "index": "47",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "1",
            "max": "3",
            "mean": "2",
            "stdev": "1"
        },
        {
            "name": "ATS6e",
            "index": "48",
            "type": "numeric",
            "distinct": "17",
            "missing": "0",
            "min": "0",
            "max": "4",
            "mean": "3",
            "stdev": "1"
        },
        {
            "name": "ATS6i",
            "index": "49",
            "type": "numeric",
            "distinct": "18",
            "missing": "0",
            "min": "0",
            "max": "4",
            "mean": "3",
            "stdev": "1"
        },
        {
            "name": "ATS6m",
            "index": "50",
            "type": "numeric",
            "distinct": "18",
            "missing": "0",
            "min": "0",
            "max": "2",
            "mean": "1",
            "stdev": "1"
        }
    ],
    "nr_of_issues": 0,
    "nr_of_downvotes": 0,
    "nr_of_likes": 0,
    "nr_of_downloads": 0,
    "total_downloads": 0,
    "reach": 0,
    "reuse": 0,
    "impact_of_reuse": 0,
    "reach_of_reuse": 0,
    "impact": 0
}