@relation QSAR-Dataset-from-ChEMBL17-for-Drug-Target-with-ChEMBL_ID:CHEMBL2724

@attribute molecule_id {CHEMBL100258,CHEMBL100484,CHEMBL1116,CHEMBL135,CHEMBL1358,CHEMBL144431,CHEMBL145576,CHEMBL186513,CHEMBL187207,CHEMBL187392,CHEMBL187673,CHEMBL188230,CHEMBL188528,CHEMBL188882,CHEMBL195560,CHEMBL1957037,CHEMBL1957038,CHEMBL1957039,CHEMBL1957040,CHEMBL1957041,CHEMBL24950,CHEMBL267385,CHEMBL316730,CHEMBL317824,CHEMBL318473,CHEMBL318496,CHEMBL318946,CHEMBL319765,CHEMBL329312,CHEMBL345000,CHEMBL439806,CHEMBL450940,CHEMBL469316,CHEMBL472469,CHEMBL536733,CHEMBL537638,CHEMBL539849,CHEMBL557981,CHEMBL81,CHEMBL95803,CHEMBL95809,CHEMBL95882,CHEMBL95883,CHEMBL95938,CHEMBL96991,CHEMBL98139,CHEMBL98565,CHEMBL99306,CHEMBL99308,CHEMBL99335}
@attribute FCFP4_1024b574 numeric
@attribute FCFP4_1024b256 numeric
@attribute FCFP4_1024b630 numeric
@attribute FCFP4_1024b1 numeric
@attribute FCFP4_1024b10 numeric
@attribute FCFP4_1024b100 numeric
@attribute FCFP4_1024b1000 numeric
@attribute FCFP4_1024b1001 numeric
@attribute FCFP4_1024b1002 numeric
@attribute FCFP4_1024b1003 numeric
@attribute FCFP4_1024b1004 numeric
@attribute FCFP4_1024b1005 numeric
@attribute FCFP4_1024b1006 numeric
@attribute FCFP4_1024b1007 numeric
@attribute FCFP4_1024b1008 numeric
@attribute FCFP4_1024b1009 numeric
@attribute FCFP4_1024b101 numeric
@attribute FCFP4_1024b1010 numeric
@attribute FCFP4_1024b1011 numeric
@attribute FCFP4_1024b1012 numeric
@attribute FCFP4_1024b1013 numeric
@attribute FCFP4_1024b1014 numeric
@attribute FCFP4_1024b1015 numeric
@attribute FCFP4_1024b1016 numeric
@attribute FCFP4_1024b1017 numeric
@attribute FCFP4_1024b1018 numeric
@attribute FCFP4_1024b1019 numeric
@attribute FCFP4_1024b102 numeric
@attribute FCFP4_1024b1020 numeric
@attribute FCFP4_1024b1021 numeric
@attribute FCFP4_1024b1022 numeric
@attribute FCFP4_1024b1023 numeric
@attribute FCFP4_1024b1024 numeric
@attribute FCFP4_1024b103 numeric
@attribute FCFP4_1024b104 numeric
@attribute FCFP4_1024b105 numeric
@attribute FCFP4_1024b106 numeric
@attribute FCFP4_1024b107 numeric
@attribute FCFP4_1024b108 numeric
@attribute FCFP4_1024b109 numeric
@attribute FCFP4_1024b11 numeric
@attribute FCFP4_1024b110 numeric
@attribute FCFP4_1024b111 numeric
@attribute FCFP4_1024b112 numeric
@attribute FCFP4_1024b113 numeric
@attribute FCFP4_1024b114 numeric
@attribute FCFP4_1024b115 numeric
@attribute FCFP4_1024b116 numeric
@attribute FCFP4_1024b117 numeric
@attribute FCFP4_1024b118 numeric
@attribute FCFP4_1024b119 numeric
@attribute pXC50 numeric

@data
{4 1,52 6.523}
{0 CHEMBL100484,4 1,52 7.523}
{0 CHEMBL1116,1 1,2 1,3 1,4 1,5 1,52 9.432}
{0 CHEMBL135,1 1,4 1,52 8.71}
{0 CHEMBL1358,1 1,4 1,52 8.23}
{0 CHEMBL144431,4 1,52 7.796}
{0 CHEMBL145576,4 1,52 8.658}
{0 CHEMBL186513,4 1,5 1,41 1,52 6.441}
{0 CHEMBL187207,12 1,41 1,52 6.767}
{0 CHEMBL187392,41 1,52 5.888}
{0 CHEMBL187673,41 1,52 6.086}
{0 CHEMBL188230,4 1,41 1,52 5.647}
{0 CHEMBL188528,12 1,41 1,52 6.879}
{0 CHEMBL188882,52 6.145}
{0 CHEMBL195560,4 1,52 6.63}
{0 CHEMBL1957037,4 1,52 5.78}
{0 CHEMBL1957038,4 1,52 6.18}
{0 CHEMBL1957039,4 1,52 5}
{0 CHEMBL1957040,4 1,52 5.12}
{0 CHEMBL1957041,4 1,52 5.44}
{0 CHEMBL24950,4 1,52 7.469}
{0 CHEMBL267385,1 1,2 1,3 1,4 1,5 1,52 8.77}
{0 CHEMBL316730,1 1,2 1,3 1,4 1,5 1,52 5.137}
{0 CHEMBL317824,4 1,52 6.42}
{0 CHEMBL318473,4 1,52 7.004}
{0 CHEMBL318496,1 1,4 1,52 5.553}
{0 CHEMBL318946,4 1,52 6.745}
{0 CHEMBL319765,4 1,27 1,52 6.42}
{0 CHEMBL329312,4 1,11 1,52 6.854}
{0 CHEMBL345000,4 1,52 5}
{0 CHEMBL439806,4 1,52 6.943}
{0 CHEMBL450940,4 1,41 1,52 6.209}
{0 CHEMBL469316,1 1,2 1,3 1,4 1,5 1,52 4.848}
{0 CHEMBL472469,1 1,4 1,5 1,52 6.082}
{0 CHEMBL536733,1 1,2 1,3 1,4 1,5 1,52 9.292}
{0 CHEMBL537638,1 1,2 1,3 1,4 1,5 1,52 9.602}
{0 CHEMBL539849,1 1,2 1,3 1,4 1,5 1,52 9.699}
{0 CHEMBL557981,1 1,2 1,3 1,4 1,5 1,52 8.939}
{0 CHEMBL81,1 1,2 1,3 1,4 1,5 1,52 8.155}
{0 CHEMBL95803,4 1,27 1,52 5.469}
{0 CHEMBL95809,4 1,27 1,52 7.125}
{0 CHEMBL95882,1 1,4 1,52 6.721}
{0 CHEMBL95883,4 1,52 6.444}
{0 CHEMBL95938,4 1,52 6.409}
{0 CHEMBL96991,4 1,52 6.699}
{0 CHEMBL98139,4 1,52 5.854}
{0 CHEMBL98565,4 1,52 6.602}
{0 CHEMBL99306,4 1,52 6.824}
{0 CHEMBL99308,1 1,2 1,3 1,4 1,5 1,52 5.319}
{0 CHEMBL99335,4 1,52 6.42}