@relation QSAR-Dataset-from-ChEMBL17-for-Drug-Target-with-ChEMBL_ID:CHEMBL2382

@attribute molecule_id {CHEMBL115426,CHEMBL115630,CHEMBL115757,CHEMBL115957,CHEMBL116036,CHEMBL116037,CHEMBL116256,CHEMBL116264,CHEMBL116358,CHEMBL116429,CHEMBL116477,CHEMBL116746,CHEMBL116863,CHEMBL116894,CHEMBL117023,CHEMBL117232,CHEMBL117255,CHEMBL117336,CHEMBL117450,CHEMBL117508,CHEMBL117706,CHEMBL117776,CHEMBL117801,CHEMBL117839,CHEMBL117840,CHEMBL117888,CHEMBL117891,CHEMBL117905,CHEMBL118025,CHEMBL118907,CHEMBL118908,CHEMBL119011,CHEMBL119622,CHEMBL129492,CHEMBL129831,CHEMBL129933,CHEMBL130107,CHEMBL130114,CHEMBL130122,CHEMBL130146,CHEMBL130215,CHEMBL130338,CHEMBL130345,CHEMBL130359,CHEMBL130506,CHEMBL130580,CHEMBL130629,CHEMBL130722,CHEMBL130753,CHEMBL130756,CHEMBL131002,CHEMBL131257,CHEMBL131264,CHEMBL131319,CHEMBL131540,CHEMBL131639,CHEMBL131707,CHEMBL131779,CHEMBL131781,CHEMBL131866,CHEMBL131879,CHEMBL132526,CHEMBL132566,CHEMBL132586,CHEMBL132587,CHEMBL132611,CHEMBL132732,CHEMBL132773,CHEMBL132839,CHEMBL132886,CHEMBL132987,CHEMBL133106,CHEMBL133243,CHEMBL133521,CHEMBL133574,CHEMBL133634,CHEMBL133707,CHEMBL133749,CHEMBL133806,CHEMBL133936,CHEMBL133970,CHEMBL134002,CHEMBL134092,CHEMBL134121,CHEMBL134142,CHEMBL134173,CHEMBL134179,CHEMBL134283,CHEMBL134508,CHEMBL177914,CHEMBL1921824,CHEMBL1921825,CHEMBL1921826,CHEMBL1921827,CHEMBL1921828,CHEMBL1921829,CHEMBL1921830,CHEMBL1921831,CHEMBL1921832,CHEMBL1921833,CHEMBL1921834,CHEMBL1921835,CHEMBL1921836,CHEMBL273817,CHEMBL315636,CHEMBL324262,CHEMBL324834,CHEMBL325147,CHEMBL325223,CHEMBL325401,CHEMBL326290,CHEMBL330186,CHEMBL331383,CHEMBL331850,CHEMBL332924,CHEMBL333388,CHEMBL334744,CHEMBL335291,CHEMBL335293,CHEMBL335706,CHEMBL336649,CHEMBL337462,CHEMBL337608,CHEMBL337635,CHEMBL337684,CHEMBL337830,CHEMBL338957,CHEMBL339174,CHEMBL339869,CHEMBL341219,CHEMBL36146,CHEMBL36801,CHEMBL36904,CHEMBL36969,CHEMBL411658,CHEMBL413308,CHEMBL419590,CHEMBL419898,CHEMBL420872,CHEMBL421910,CHEMBL422260,CHEMBL423112,CHEMBL423704,CHEMBL424074,CHEMBL432443,CHEMBL435203,CHEMBL439798,CHEMBL441280,CHEMBL444594,CHEMBL88646,CHEMBL88895,CHEMBL89008,CHEMBL89100,CHEMBL89766,CHEMBL91991,CHEMBL92114,CHEMBL98777}
@attribute FCFP4_1024b131 numeric
@attribute FCFP4_1024b410 numeric
@attribute FCFP4_1024b63 numeric
@attribute FCFP4_1024b144 numeric
@attribute FCFP4_1024b986 numeric
@attribute FCFP4_1024b651 numeric
@attribute FCFP4_1024b208 numeric
@attribute FCFP4_1024b861 numeric
@attribute FCFP4_1024b853 numeric
@attribute FCFP4_1024b669 numeric
@attribute FCFP4_1024b438 numeric
@attribute FCFP4_1024b859 numeric
@attribute FCFP4_1024b1022 numeric
@attribute FCFP4_1024b218 numeric
@attribute FCFP4_1024b844 numeric
@attribute FCFP4_1024b68 numeric
@attribute FCFP4_1024b891 numeric
@attribute FCFP4_1024b872 numeric
@attribute FCFP4_1024b406 numeric
@attribute FCFP4_1024b985 numeric
@attribute FCFP4_1024b971 numeric
@attribute FCFP4_1024b936 numeric
@attribute FCFP4_1024b521 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_1024b1023 numeric
@attribute pXC50 numeric

@data
{3 1,4 1,5 1,6 1,8 1,10 1,12 1,17 1,24 1,52 5.721}
{0 CHEMBL115630,3 1,4 1,5 1,17 1,24 1,52 6.328}
{0 CHEMBL115757,1 1,2 1,7 1,12 1,17 1,24 1,52 6.854}
{0 CHEMBL115957,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 5.658}
{0 CHEMBL116036,1 1,2 1,7 1,12 1,17 1,24 1,52 6.222}
{0 CHEMBL116037,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 5.854}
{0 CHEMBL116256,1 1,2 1,7 1,12 1,17 1,24 1,52 7.229}
{0 CHEMBL116264,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 4.77}
{0 CHEMBL116358,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 6.745}
{0 CHEMBL116429,1 1,2 1,7 1,12 1,17 1,24 1,52 7.174}
{0 CHEMBL116477,1 1,2 1,7 1,12 1,17 1,24 1,52 7.301}
{0 CHEMBL116746,2 1,17 1,24 1,52 6.119}
{0 CHEMBL116863,1 1,2 1,7 1,12 1,17 1,24 1,52 6.602}
{0 CHEMBL116894,1 1,2 1,7 1,12 1,17 1,24 1,52 7.056}
{0 CHEMBL117023,17 1,24 1,52 8.244}
{0 CHEMBL117232,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 6.398}
{0 CHEMBL117255,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 5.824}
{0 CHEMBL117336,1 1,2 1,7 1,12 1,17 1,24 1,52 7.658}
{0 CHEMBL117450,3 1,4 1,5 1,6 1,10 1,17 1,18 1,24 1,52 5.959}
{0 CHEMBL117508,3 1,4 1,5 1,17 1,24 1,52 6.301}
{0 CHEMBL117706,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 6.585}
{0 CHEMBL117776,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 6.699}
{0 CHEMBL117801,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 5.921}
{0 CHEMBL117839,17 1,24 1,52 5.585}
{0 CHEMBL117840,2 1,17 1,24 1,52 7.108}
{0 CHEMBL117888,1 1,2 1,7 1,12 1,17 1,24 1,52 7.357}
{0 CHEMBL117891,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 5.921}
{0 CHEMBL117905,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 6.398}
{0 CHEMBL118025,1 1,2 1,17 1,24 1,52 7.658}
{0 CHEMBL118907,3 1,4 1,5 1,6 1,8 1,10 1,12 1,17 1,24 1,52 5.538}
{0 CHEMBL118908,17 1,24 1,52 7.658}
{0 CHEMBL119011,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 5.721}
{0 CHEMBL119622,1 1,2 1,7 1,12 1,17 1,24 1,52 7.367}
{0 CHEMBL129492,1 1,2 1,17 1,21 1,23 1,24 1,52 9.444}
{0 CHEMBL129831,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,24 1,52 9.699}
{0 CHEMBL129933,1 1,2 1,17 1,21 1,23 1,24 1,52 9.569}
{0 CHEMBL130107,1 1,2 1,7 1,10 1,12 1,17 1,24 1,25 1,52 9.796}
{0 CHEMBL130114,1 1,2 1,17 1,21 1,23 1,24 1,52 10.77}
{0 CHEMBL130122,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.387}
{0 CHEMBL130146,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 10}
{0 CHEMBL130215,1 1,2 1,7 1,12 1,17 1,24 1,52 9.602}
{0 CHEMBL130338,1 1,2 1,7 1,12 1,17 1,24 1,52 10.066}
{0 CHEMBL130345,1 1,2 1,7 1,8 1,10 1,12 1,17 1,24 1,52 9.796}
{0 CHEMBL130359,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,43 1,52 9.658}
{0 CHEMBL130506,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 10.824}
{0 CHEMBL130580,1 1,2 1,7 1,12 1,17 1,21 1,23 1,24 1,52 9.959}
{0 CHEMBL130629,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,47 1,52 9.745}
{0 CHEMBL130722,1 1,2 1,7 1,12 1,17 1,21 1,23 1,24 1,52 9.081}
{0 CHEMBL130753,1 1,2 1,7 1,12 1,17 1,24 1,52 10.222}
{0 CHEMBL130756,1 1,2 1,7 1,12 1,17 1,24 1,52 9.796}
{0 CHEMBL131002,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.538}
{0 CHEMBL131257,1 1,2 1,7 1,12 1,17 1,21 1,23 1,24 1,52 9.237}
{0 CHEMBL131264,1 1,2 1,7 1,10 1,12 1,17 1,24 1,52 9.796}
{0 CHEMBL131319,1 1,2 1,7 1,10 1,12 1,17 1,18 1,24 1,52 10.18}
{0 CHEMBL131540,1 1,2 1,7 1,12 1,17 1,24 1,52 10.301}
{0 CHEMBL131639,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.921}
{0 CHEMBL131707,1 1,2 1,7 1,12 1,17 1,21 1,23 1,24 1,52 9.523}
{0 CHEMBL131779,1 1,2 1,7 1,12 1,17 1,24 1,52 8.921}
{0 CHEMBL131781,1 1,2 1,7 1,12 1,17 1,24 1,52 10.161}
{0 CHEMBL131866,1 1,2 1,17 1,24 1,52 10.081}
{0 CHEMBL131879,1 1,2 1,7 1,12 1,17 1,24 1,25 1,49 1,52 9.721}
{0 CHEMBL132526,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.699}
{0 CHEMBL132566,1 1,2 1,7 1,10 1,12 1,17 1,24 1,36 1,52 9.796}
{0 CHEMBL132586,1 1,2 1,17 1,21 1,23 1,24 1,52 9.921}
{0 CHEMBL132587,1 1,2 1,7 1,10 1,12 1,17 1,24 1,25 1,52 10.131}
{0 CHEMBL132611,1 1,2 1,7 1,12 1,17 1,24 1,25 1,52 9.585}
{0 CHEMBL132732,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.509}
{0 CHEMBL132773,1 1,2 1,7 1,12 1,17 1,21 1,24 1,52 10.119}
{0 CHEMBL132839,1 1,2 1,7 1,12 1,17 1,21 1,23 1,24 1,52 9.328}
{0 CHEMBL132886,1 1,2 1,7 1,10 1,12 1,17 1,24 1,25 1,52 9.959}
{0 CHEMBL132987,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,24 1,52 9.77}
{0 CHEMBL133106,1 1,2 1,7 1,12 1,17 1,24 1,52 10.292}
{0 CHEMBL133243,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 7.959}
{0 CHEMBL133521,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.921}
{0 CHEMBL133574,1 1,2 1,7 1,12 1,17 1,24 1,25 1,49 1,52 9.699}
{0 CHEMBL133634,1 1,2 1,7 1,12 1,17 1,21 1,23 1,24 1,52 10.167}
{0 CHEMBL133707,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.921}
{0 CHEMBL133749,1 1,2 1,17 1,24 1,52 9.824}
{0 CHEMBL133806,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.174}
{0 CHEMBL133936,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.77}
{0 CHEMBL133970,1 1,2 1,17 1,21 1,23 1,24 1,52 9.222}
{0 CHEMBL134002,1 1,2 1,7 1,10 1,12 1,17 1,24 1,25 1,52 10.387}
{0 CHEMBL134092,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.553}
{0 CHEMBL134121,1 1,2 1,7 1,12 1,17 1,24 1,36 1,52 10.108}
{0 CHEMBL134142,1 1,2 1,17 1,21 1,23 1,24 1,52 9.959}
{0 CHEMBL134173,1 1,2 1,7 1,12 1,17 1,24 1,52 10.337}
{0 CHEMBL134179,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 10.301}
{0 CHEMBL134283,1 1,2 1,17 1,21 1,23 1,24 1,52 10.638}
{0 CHEMBL134508,1 1,2 1,7 1,12 1,17 1,24 1,25 1,52 9.569}
{0 CHEMBL177914,24 1,52 6.735}
{0 CHEMBL1921824,3 1,10 1,18 1,19 1,20 1,24 1,52 5.431}
{0 CHEMBL1921825,3 1,10 1,18 1,19 1,20 1,24 1,52 6.553}
{0 CHEMBL1921826,3 1,10 1,18 1,19 1,20 1,24 1,52 5.62}
{0 CHEMBL1921827,10 1,18 1,19 1,20 1,24 1,52 6.071}
{0 CHEMBL1921828,10 1,12 1,18 1,19 1,20 1,24 1,52 4.509}
{0 CHEMBL1921829,10 1,18 1,19 1,20 1,24 1,52 7.071}
{0 CHEMBL1921830,10 1,18 1,19 1,20 1,24 1,52 7.523}
{0 CHEMBL1921831,10 1,12 1,18 1,19 1,20 1,24 1,52 6.155}
{0 CHEMBL1921832,10 1,18 1,19 1,20 1,24 1,52 6.745}
{0 CHEMBL1921833,10 1,12 1,18 1,19 1,20 1,24 1,52 5.959}
{0 CHEMBL1921834,10 1,18 1,19 1,20 1,24 1,52 6.53}
{0 CHEMBL1921835,10 1,18 1,19 1,20 1,24 1,52 5.996}
{0 CHEMBL1921836,10 1,12 1,18 1,19 1,20 1,24 1,52 4.553}
{0 CHEMBL273817,1 1,2 1,7 1,10 1,12 1,17 1,24 1,36 1,52 9.553}
{0 CHEMBL315636,9 1,10 1,11 1,16 1,24 1,52 8.301}
{0 CHEMBL324262,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 7.046}
{0 CHEMBL324834,3 1,4 1,5 1,17 1,24 1,52 5.796}
{0 CHEMBL325147,1 1,2 1,7 1,12 1,17 1,24 1,52 6.678}
{0 CHEMBL325223,1 1,2 1,7 1,12 1,17 1,24 1,52 7.721}
{0 CHEMBL325401,2 1,17 1,24 1,52 7.721}
{0 CHEMBL326290,1 1,2 1,7 1,12 1,17 1,24 1,52 7.201}
{0 CHEMBL330186,7 1,12 1,24 1,52 6.887}
{0 CHEMBL331383,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 5.854}
{0 CHEMBL331850,1 1,2 1,7 1,12 1,17 1,24 1,52 7.62}
{0 CHEMBL332924,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 5.796}
{0 CHEMBL333388,3 1,4 1,5 1,6 1,10 1,17 1,18 1,24 1,52 6.398}
{0 CHEMBL334744,1 1,2 1,7 1,12 1,17 1,24 1,52 10}
{0 CHEMBL335291,1 1,2 1,7 1,10 1,12 1,17 1,24 1,25 1,52 9.481}
{0 CHEMBL335293,1 1,2 1,17 1,24 1,52 10.658}
{0 CHEMBL335706,1 1,2 1,7 1,12 1,17 1,24 1,52 9.886}
{0 CHEMBL336649,1 1,2 1,7 1,10 1,12 1,17 1,24 1,25 1,52 10}
{0 CHEMBL337462,1 1,2 1,7 1,12 1,17 1,21 1,23 1,24 1,52 9.319}
{0 CHEMBL337608,1 1,2 1,9 1,17 1,23 1,24 1,52 8.337}
{0 CHEMBL337635,1 1,2 1,7 1,12 1,17 1,24 1,25 1,52 9.699}
{0 CHEMBL337684,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.469}
{0 CHEMBL337830,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.62}
{0 CHEMBL338957,1 1,2 1,7 1,10 1,12 1,17 1,24 1,52 8.004}
{0 CHEMBL339174,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,24 1,52 9.456}
{0 CHEMBL339869,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.137}
{0 CHEMBL341219,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.229}
{0 CHEMBL36146,24 1,52 6.735}
{0 CHEMBL36801,24 1,52 6.983}
{0 CHEMBL36904,24 1,52 6.983}
{0 CHEMBL36969,10 1,18 1,19 1,20 1,24 1,52 7.099}
{0 CHEMBL411658,3 1,4 1,5 1,6 1,8 1,10 1,17 1,24 1,52 6.398}
{0 CHEMBL413308,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.347}
{0 CHEMBL419590,1 1,2 1,17 1,24 1,52 7.337}
{0 CHEMBL419898,7 1,12 1,24 1,52 7.257}
{0 CHEMBL420872,1 1,2 1,7 1,12 1,17 1,24 1,52 7.409}
{0 CHEMBL421910,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,52 9.959}
{0 CHEMBL422260,1 1,2 1,17 1,21 1,23 1,24 1,52 9.824}
{0 CHEMBL423112,24 1,52 6.456}
{0 CHEMBL423704,1 1,2 1,17 1,21 1,23 1,24 1,52 10.046}
{0 CHEMBL424074,1 1,2 1,17 1,21 1,23 1,24 1,52 10.481}
{0 CHEMBL432443,1 1,2 1,7 1,12 1,17 1,24 1,52 7.553}
{0 CHEMBL435203,1 1,2 1,7 1,12 1,13 1,14 1,15 1,17 1,22 1,24 1,47 1,52 9.538}
{0 CHEMBL439798,1 1,2 1,17 1,21 1,23 1,24 1,52 9.921}
{0 CHEMBL441280,1 1,2 1,7 1,12 1,17 1,24 1,52 7.187}
{0 CHEMBL444594,1 1,2 1,7 1,12 1,17 1,24 1,52 7.301}
{0 CHEMBL88646,9 1,11 1,16 1,24 1,52 7.886}
{0 CHEMBL88895,9 1,11 1,16 1,21 1,23 1,24 1,52 7.959}
{0 CHEMBL89008,9 1,10 1,11 1,24 1,52 8.046}
{0 CHEMBL89100,3 1,9 1,10 1,11 1,12 1,16 1,24 1,52 7.77}
{0 CHEMBL89766,9 1,11 1,16 1,24 1,42 1,52 8.155}
{0 CHEMBL91991,9 1,10 1,11 1,16 1,24 1,52 8.301}
{0 CHEMBL92114,9 1,10 1,11 1,16 1,24 1,52 8.155}
{0 CHEMBL98777,7 1,12 1,24 1,52 7.374}