@relation QSAR-Dataset-from-ChEMBL17-for-Drug-Target-with-ChEMBL_ID:CHEMBL4729

@attribute molecule_id {CHEMBL1078442,CHEMBL1091356,CHEMBL1110,CHEMBL116438,CHEMBL117,CHEMBL1179,CHEMBL1258517,CHEMBL1289053,CHEMBL1289283,CHEMBL1289395,CHEMBL1289396,CHEMBL1289515,CHEMBL1290155,CHEMBL1290264,CHEMBL149808,CHEMBL163,CHEMBL1643880,CHEMBL1643881,CHEMBL1643883,CHEMBL1650645,CHEMBL1650652,CHEMBL1650654,CHEMBL1743344,CHEMBL1743351,CHEMBL1771,CHEMBL1774933,CHEMBL178090,CHEMBL178516,CHEMBL178711,CHEMBL178780,CHEMBL179005,CHEMBL179398,CHEMBL179529,CHEMBL179618,CHEMBL179621,CHEMBL179669,CHEMBL179704,CHEMBL1921976,CHEMBL1933349,CHEMBL195217,CHEMBL2018903,CHEMBL2018904,CHEMBL2018905,CHEMBL2018906,CHEMBL2018907,CHEMBL2018908,CHEMBL2018909,CHEMBL2018910,CHEMBL2018911,CHEMBL2018912,CHEMBL2018913,CHEMBL2018914,CHEMBL2018915,CHEMBL2018916,CHEMBL2018917,CHEMBL2018918,CHEMBL2018919,CHEMBL2018920,CHEMBL2018921,CHEMBL2018922,CHEMBL2018923,CHEMBL2018924,CHEMBL2018925,CHEMBL2018926,CHEMBL2019022,CHEMBL2019023,CHEMBL2019024,CHEMBL2019025,CHEMBL2019026,CHEMBL202376,CHEMBL2036208,CHEMBL2036209,CHEMBL2036210,CHEMBL2036211,CHEMBL2036212,CHEMBL2036213,CHEMBL2036214,CHEMBL2036215,CHEMBL207831,CHEMBL208528,CHEMBL214784,CHEMBL214859,CHEMBL214990,CHEMBL215134,CHEMBL215174,CHEMBL215183,CHEMBL2170062,CHEMBL2170747,CHEMBL2170750,CHEMBL2170754,CHEMBL217125,CHEMBL2178422,CHEMBL218397,CHEMBL2204469,CHEMBL2347754,CHEMBL2347755,CHEMBL2347756,CHEMBL2347757,CHEMBL2347758,CHEMBL2347759,CHEMBL2347911,CHEMBL2347912,CHEMBL2347913,CHEMBL2347914,CHEMBL2347915,CHEMBL2347916,CHEMBL2347917,CHEMBL2347918,CHEMBL242983,CHEMBL244239,CHEMBL257990,CHEMBL26260,CHEMBL264241,CHEMBL266212,CHEMBL275528,CHEMBL283196,CHEMBL296580,CHEMBL348475,CHEMBL359657,CHEMBL360541,CHEMBL360999,CHEMBL361153,CHEMBL361364,CHEMBL385008,CHEMBL386124,CHEMBL386250,CHEMBL407034,CHEMBL410355,CHEMBL425519,CHEMBL446083,CHEMBL447591,CHEMBL448743,CHEMBL453169,CHEMBL456379,CHEMBL456390,CHEMBL460178,CHEMBL462093,CHEMBL462513,CHEMBL469227,CHEMBL488400,CHEMBL493001,CHEMBL498371,CHEMBL498373,CHEMBL499007,CHEMBL500394,CHEMBL502335,CHEMBL502824,CHEMBL502908,CHEMBL551991,CHEMBL62811,CHEMBL638,CHEMBL671,CHEMBL691,CHEMBL83,CHEMBL833}
@attribute FCFP4_1024b87 numeric
@attribute FCFP4_1024b538 numeric
@attribute FCFP4_1024b986 numeric
@attribute FCFP4_1024b298 numeric
@attribute FCFP4_1024b393 numeric
@attribute FCFP4_1024b587 numeric
@attribute FCFP4_1024b824 numeric
@attribute FCFP4_1024b905 numeric
@attribute FCFP4_1024b171 numeric
@attribute FCFP4_1024b229 numeric
@attribute FCFP4_1024b1001 numeric
@attribute FCFP4_1024b346 numeric
@attribute FCFP4_1024b635 numeric
@attribute FCFP4_1024b652 numeric
@attribute FCFP4_1024b964 numeric
@attribute FCFP4_1024b975 numeric
@attribute FCFP4_1024b205 numeric
@attribute FCFP4_1024b430 numeric
@attribute FCFP4_1024b1 numeric
@attribute FCFP4_1024b10 numeric
@attribute FCFP4_1024b100 numeric
@attribute FCFP4_1024b1000 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 pXC50 numeric

@data
{3 1,19 1,52 5.284}
{0 CHEMBL1091356,19 1,20 1,23 1,52 4.523}
{0 CHEMBL1110,19 1,52 5}
{0 CHEMBL116438,19 1,52 4.611}
{0 CHEMBL117,19 1,52 4.602}
{0 CHEMBL1179,19 1,52 5.181}
{0 CHEMBL1258517,19 1,52 4.523}
{0 CHEMBL1289053,1 1,3 1,4 1,9 1,11 1,12 1,13 1,14 1,15 1,16 1,19 1,52 5}
{0 CHEMBL1289283,1 1,3 1,4 1,9 1,11 1,12 1,13 1,14 1,15 1,16 1,19 1,20 1,52 5}
{0 CHEMBL1289395,1 1,3 1,9 1,10 1,11 1,12 1,13 1,14 1,15 1,16 1,19 1,48 1,52 5}
{0 CHEMBL1289396,1 1,3 1,9 1,11 1,12 1,13 1,14 1,15 1,16 1,19 1,20 1,52 5}
{0 CHEMBL1289515,1 1,3 1,4 1,9 1,11 1,12 1,13 1,14 1,15 1,16 1,19 1,20 1,52 5}
{0 CHEMBL1290155,1 1,3 1,9 1,11 1,12 1,13 1,14 1,15 1,16 1,19 1,48 1,52 5}
{0 CHEMBL1290264,1 1,3 1,9 1,11 1,12 1,13 1,14 1,15 1,16 1,19 1,20 1,52 5}
{0 CHEMBL149808,19 1,51 1,52 4.222}
{0 CHEMBL163,19 1,52 5.699}
{0 CHEMBL1643880,19 1,20 1,51 1,52 5}
{0 CHEMBL1643881,19 1,20 1,22 1,36 1,52 5}
{0 CHEMBL1643883,4 1,19 1,20 1,36 1,52 5}
{0 CHEMBL1650645,52 5.272}
{0 CHEMBL1650652,52 4.926}
{0 CHEMBL1650654,43 1,52 4.983}
{0 CHEMBL1743344,4 1,19 1,20 1,52 5.921}
{0 CHEMBL1743351,19 1,52 5.292}
{0 CHEMBL1771,3 1,19 1,20 1,52 5.959}
{0 CHEMBL1774933,4 1,19 1,43 1,52 4.523}
{0 CHEMBL178090,19 1,52 4.02}
{0 CHEMBL178516,17 1,52 4.288}
{0 CHEMBL178711,19 1,52 5.046}
{0 CHEMBL178780,19 1,52 5.276}
{0 CHEMBL179005,33 1,52 4.142}
{0 CHEMBL179398,19 1,52 4.666}
{0 CHEMBL179529,19 1,52 5.167}
{0 CHEMBL179618,52 4.15}
{0 CHEMBL179621,19 1,52 5.229}
{0 CHEMBL179669,19 1,52 5.565}
{0 CHEMBL179704,19 1,52 5.355}
{0 CHEMBL1921976,19 1,37 1,52 4.523}
{0 CHEMBL1933349,4 1,19 1,52 4.638}
{0 CHEMBL195217,52 4.873}
{0 CHEMBL2018903,19 1,48 1,52 4.301}
{0 CHEMBL2018904,19 1,48 1,52 4.979}
{0 CHEMBL2018905,19 1,48 1,52 4.301}
{0 CHEMBL2018906,19 1,48 1,52 5.292}
{0 CHEMBL2018907,19 1,48 1,52 4.812}
{0 CHEMBL2018908,19 1,48 1,52 4.83}
{0 CHEMBL2018909,19 1,48 1,52 4.301}
{0 CHEMBL2018910,19 1,48 1,52 4.78}
{0 CHEMBL2018911,19 1,48 1,52 4.301}
{0 CHEMBL2018912,19 1,48 1,52 4.67}
{0 CHEMBL2018913,19 1,48 1,52 5.26}
{0 CHEMBL2018914,19 1,48 1,52 4.541}
{0 CHEMBL2018915,9 1,19 1,48 1,52 4.301}
{0 CHEMBL2018916,9 1,19 1,48 1,52 4.752}
{0 CHEMBL2018917,9 1,19 1,48 1,52 4.842}
{0 CHEMBL2018918,9 1,19 1,21 1,48 1,52 4.301}
{0 CHEMBL2018919,9 1,19 1,48 1,52 5.444}
{0 CHEMBL2018920,9 1,19 1,48 1,52 5.018}
{0 CHEMBL2018921,9 1,19 1,48 1,52 5.357}
{0 CHEMBL2018922,9 1,19 1,32 1,48 1,52 4.301}
{0 CHEMBL2018923,9 1,19 1,23 1,48 1,52 5.959}
{0 CHEMBL2018924,19 1,48 1,52 4.81}
{0 CHEMBL2018925,9 1,19 1,48 1,52 5.699}
{0 CHEMBL2018926,9 1,19 1,48 1,52 4.301}
{0 CHEMBL2019022,19 1,48 1,52 4.301}
{0 CHEMBL2019023,19 1,48 1,52 5.004}
{0 CHEMBL2019024,19 1,48 1,52 4.301}
{0 CHEMBL2019025,19 1,48 1,52 4.662}
{0 CHEMBL2019026,19 1,43 1,48 1,52 5.076}
{0 CHEMBL202376,19 1,35 1,52 4.155}
{0 CHEMBL2036208,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,17 1,18 1,19 1,41 1,52 5}
{0 CHEMBL2036209,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,17 1,18 1,19 1,52 5}
{0 CHEMBL2036210,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,17 1,18 1,19 1,52 5}
{0 CHEMBL2036211,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,17 1,18 1,19 1,40 1,52 5}
{0 CHEMBL2036212,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,17 1,18 1,19 1,40 1,52 5}
{0 CHEMBL2036213,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,17 1,18 1,19 1,52 5}
{0 CHEMBL2036214,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,17 1,18 1,19 1,40 1,52 5}
{0 CHEMBL2036215,1 1,2 1,3 1,4 1,5 1,6 1,7 1,8 1,9 1,10 1,17 1,18 1,19 1,40 1,52 5}
{0 CHEMBL207831,19 1,20 1,52 4.678}
{0 CHEMBL208528,19 1,20 1,52 4.553}
{0 CHEMBL214784,19 1,52 5.959}
{0 CHEMBL214859,19 1,52 5.42}
{0 CHEMBL214990,19 1,52 4.329}
{0 CHEMBL215134,19 1,52 6.222}
{0 CHEMBL215174,19 1,52 5.276}
{0 CHEMBL215183,19 1,52 5.292}
{0 CHEMBL2170062,4 1,19 1,20 1,52 5}
{0 CHEMBL2170747,19 1,52 4.268}
{0 CHEMBL2170750,19 1,52 4.268}
{0 CHEMBL2170754,19 1,52 4.268}
{0 CHEMBL217125,4 1,19 1,52 4.472}
{0 CHEMBL2178422,19 1,52 4.699}
{0 CHEMBL218397,22 1,52 4.146}
{0 CHEMBL2204469,3 1,19 1,24 1,52 4.796}
{0 CHEMBL2347754,19 1,52 4.602}
{0 CHEMBL2347755,19 1,52 4.602}
{0 CHEMBL2347756,19 1,52 4.602}
{0 CHEMBL2347757,19 1,52 5.201}
{0 CHEMBL2347758,19 1,52 5.148}
{0 CHEMBL2347759,19 1,41 1,52 5.179}
{0 CHEMBL2347911,19 1,52 4.602}
{0 CHEMBL2347912,19 1,52 4.602}
{0 CHEMBL2347913,19 1,52 4.602}
{0 CHEMBL2347914,19 1,52 5.389}
{0 CHEMBL2347915,19 1,52 4.602}
{0 CHEMBL2347916,19 1,52 4.602}
{0 CHEMBL2347917,19 1,52 4.602}
{0 CHEMBL2347918,19 1,41 1,52 4.602}
{0 CHEMBL242983,1 1,19 1,20 1,52 4}
{0 CHEMBL244239,19 1,20 1,52 4}
{0 CHEMBL257990,19 1,52 5.157}
{0 CHEMBL26260,19 1,52 4.602}
{0 CHEMBL264241,3 1,19 1,52 4.757}
{0 CHEMBL266212,1 1,19 1,20 1,52 4}
{0 CHEMBL275528,2 1,19 1,20 1,52 5}
{0 CHEMBL283196,19 1,52 4.886}
{0 CHEMBL296580,19 1,48 1,52 4.62}
{0 CHEMBL348475,19 1,20 1,52 4}
{0 CHEMBL359657,19 1,52 4.433}
{0 CHEMBL360541,19 1,52 4.084}
{0 CHEMBL360999,19 1,52 4.137}
{0 CHEMBL361153,33 1,52 4.376}
{0 CHEMBL361364,19 1,52 4.08}
{0 CHEMBL385008,19 1,22 1,52 4.479}
{0 CHEMBL386124,3 1,19 1,52 6.046}
{0 CHEMBL386250,33 1,52 4.854}
{0 CHEMBL407034,19 1,41 1,52 4.349}
{0 CHEMBL410355,19 1,52 4.362}
{0 CHEMBL425519,19 1,52 4.928}
{0 CHEMBL446083,3 1,18 1,19 1,23 1,52 4.301}
{0 CHEMBL447591,19 1,52 4.602}
{0 CHEMBL448743,19 1,23 1,52 4.301}
{0 CHEMBL453169,19 1,43 1,52 4.301}
{0 CHEMBL456379,52 5.398}
{0 CHEMBL456390,19 1,23 1,52 4}
{0 CHEMBL460178,19 1,23 1,43 1,52 4.324}
{0 CHEMBL462093,19 1,23 1,35 1,52 4.301}
{0 CHEMBL462513,52 5.398}
{0 CHEMBL469227,52 5.099}
{0 CHEMBL488400,9 1,19 1,48 1,52 4.701}
{0 CHEMBL493001,19 1,52 4.606}
{0 CHEMBL498371,10 1,19 1,41 1,52 4.129}
{0 CHEMBL498373,10 1,19 1,52 4.155}
{0 CHEMBL499007,19 1,23 1,35 1,52 4.301}
{0 CHEMBL500394,19 1,52 4.781}
{0 CHEMBL502335,9 1,19 1,48 1,52 4.9}
{0 CHEMBL502824,19 1,23 1,52 4.301}
{0 CHEMBL502908,52 5.398}
{0 CHEMBL551991,3 1,19 1,20 1,52 4.398}
{0 CHEMBL62811,19 1,23 1,52 4.301}
{0 CHEMBL638,4 1,19 1,52 5.744}
{0 CHEMBL671,19 1,20 1,52 5.539}
{0 CHEMBL691,19 1,52 6.072}
{0 CHEMBL83,19 1,20 1,52 6.046}
{0 CHEMBL833,19 1,20 1,52 6.398}