@relation QSAR-Dataset-from-ChEMBL17-for-Drug-Target-with-ChEMBL_ID:CHEMBL3520

@attribute molecule_id {CHEMBL1242210,CHEMBL1300733,CHEMBL1304188,CHEMBL1307433,CHEMBL1308032,CHEMBL1311049,CHEMBL1312387,CHEMBL1324305,CHEMBL1330933,CHEMBL1332360,CHEMBL1332727,CHEMBL1341748,CHEMBL1352143,CHEMBL1353467,CHEMBL1363372,CHEMBL1364504,CHEMBL1366864,CHEMBL1368980,CHEMBL1372163,CHEMBL1373988,CHEMBL1377318,CHEMBL1379032,CHEMBL1379276,CHEMBL1380059,CHEMBL1386474,CHEMBL1388510,CHEMBL1391017,CHEMBL1398696,CHEMBL1400936,CHEMBL1403276,CHEMBL1404472,CHEMBL1409203,CHEMBL1409738,CHEMBL1409886,CHEMBL1410623,CHEMBL1420689,CHEMBL1421032,CHEMBL1425823,CHEMBL1426649,CHEMBL1432463,CHEMBL1432472,CHEMBL1456738,CHEMBL1457248,CHEMBL1459572,CHEMBL1459808,CHEMBL1460846,CHEMBL1461873,CHEMBL1462631,CHEMBL1471924,CHEMBL1480178,CHEMBL1489711,CHEMBL1489869,CHEMBL1491713,CHEMBL1501734,CHEMBL1503299,CHEMBL1508185,CHEMBL1511729,CHEMBL1516078,CHEMBL1518977,CHEMBL1525655,CHEMBL1529254,CHEMBL1539200,CHEMBL1545983,CHEMBL1549101,CHEMBL1549770,CHEMBL1554437,CHEMBL1556043,CHEMBL1565220,CHEMBL1566010,CHEMBL1569933,CHEMBL1572461,CHEMBL1572500,CHEMBL1586266,CHEMBL1592829,CHEMBL1597829,CHEMBL1598484,CHEMBL1604061,CHEMBL1705379,CHEMBL1705738,CHEMBL1725136,CHEMBL1725334,CHEMBL1741388,CHEMBL1868777,CHEMBL1874598,CHEMBL1879359,CHEMBL1887461,CHEMBL2029048,CHEMBL2130789,CHEMBL2145165,CHEMBL329691,CHEMBL98987}
@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 FCFP4_1024b12 numeric
@attribute FCFP4_1024b120 numeric
@attribute FCFP4_1024b121 numeric
@attribute pXC50 numeric

@data
{1 1,2 1,52 8.706}
{0 CHEMBL1300733,1 1,35 1,52 4.748}
{0 CHEMBL1304188,1 1,52 4.173}
{0 CHEMBL1307433,1 1,7 1,52 4.18}
{0 CHEMBL1308032,1 1,2 1,8 1,52 4.787}
{0 CHEMBL1311049,1 1,10 1,52 4.174}
{0 CHEMBL1312387,1 1,35 1,52 4.874}
{0 CHEMBL1324305,1 1,52 4.349}
{0 CHEMBL1330933,1 1,31 1,35 1,52 4.789}
{0 CHEMBL1332360,1 1,35 1,52 4.174}
{0 CHEMBL1332727,1 1,35 1,52 4.363}
{0 CHEMBL1341748,52 4.267}
{0 CHEMBL1352143,1 1,8 1,52 4.489}
{0 CHEMBL1353467,1 1,52 4.317}
{0 CHEMBL1363372,1 1,35 1,52 4.712}
{0 CHEMBL1364504,1 1,52 4.174}
{0 CHEMBL1366864,1 1,13 1,52 4.174}
{0 CHEMBL1368980,1 1,35 1,52 4.521}
{0 CHEMBL1372163,1 1,25 1,35 1,52 4.765}
{0 CHEMBL1373988,1 1,52 4.174}
{0 CHEMBL1377318,1 1,2 1,35 1,52 4.444}
{0 CHEMBL1379032,1 1,35 1,52 4.563}
{0 CHEMBL1379276,1 1,2 1,35 1,52 4.557}
{0 CHEMBL1380059,52 4.659}
{0 CHEMBL1386474,1 1,40 1,52 4.174}
{0 CHEMBL1388510,1 1,33 1,52 4.718}
{0 CHEMBL1391017,1 1,35 1,52 4.764}
{0 CHEMBL1398696,1 1,25 1,52 4.174}
{0 CHEMBL1400936,1 1,2 1,35 1,52 4.803}
{0 CHEMBL1403276,1 1,52 4.174}
{0 CHEMBL1404472,1 1,7 1,52 4.6}
{0 CHEMBL1409203,1 1,52 4.174}
{0 CHEMBL1409738,1 1,24 1,35 1,52 4.365}
{0 CHEMBL1409886,1 1,2 1,10 1,18 1,35 1,52 4.258}
{0 CHEMBL1410623,1 1,26 1,35 1,52 4.174}
{0 CHEMBL1420689,1 1,8 1,35 1,52 4.767}
{0 CHEMBL1421032,1 1,52 4.688}
{0 CHEMBL1425823,1 1,52 4.174}
{0 CHEMBL1426649,1 1,35 1,50 1,52 4.174}
{0 CHEMBL1432463,1 1,35 1,50 1,52 4.174}
{0 CHEMBL1432472,1 1,52 4.241}
{0 CHEMBL1456738,1 1,19 1,35 1,52 4.174}
{0 CHEMBL1457248,1 1,21 1,35 1,52 4.287}
{0 CHEMBL1459572,1 1,2 1,20 1,21 1,52 4.173}
{0 CHEMBL1459808,1 1,35 1,52 4.174}
{0 CHEMBL1460846,1 1,35 1,50 1,52 4.341}
{0 CHEMBL1461873,1 1,35 1,52 4.491}
{0 CHEMBL1462631,1 1,2 1,4 1,52 4.174}
{0 CHEMBL1471924,52 4.551}
{0 CHEMBL1480178,1 1,35 1,52 4.192}
{0 CHEMBL1489711,1 1,35 1,52 4.174}
{0 CHEMBL1489869,1 1,52 4.614}
{0 CHEMBL1491713,1 1,52 4.174}
{0 CHEMBL1501734,1 1,35 1,52 4.174}
{0 CHEMBL1503299,1 1,35 1,52 4.869}
{0 CHEMBL1508185,1 1,21 1,52 4.492}
{0 CHEMBL1511729,1 1,23 1,35 1,52 4.588}
{0 CHEMBL1516078,1 1,2 1,10 1,21 1,35 1,52 4.174}
{0 CHEMBL1518977,1 1,35 1,52 4.918}
{0 CHEMBL1525655,1 1,52 4.173}
{0 CHEMBL1529254,52 4.351}
{0 CHEMBL1539200,1 1,33 1,35 1,52 4.458}
{0 CHEMBL1545983,1 1,52 4.745}
{0 CHEMBL1549101,1 1,35 1,52 4.375}
{0 CHEMBL1549770,1 1,33 1,35 1,52 4.66}
{0 CHEMBL1554437,1 1,35 1,52 4.888}
{0 CHEMBL1556043,1 1,8 1,50 1,52 4.661}
{0 CHEMBL1565220,1 1,50 1,52 4.582}
{0 CHEMBL1566010,1 1,2 1,52 4.174}
{0 CHEMBL1569933,1 1,35 1,52 4.42}
{0 CHEMBL1572461,1 1,16 1,52 4.308}
{0 CHEMBL1572500,42 1,52 4.173}
{0 CHEMBL1586266,1 1,12 1,17 1,21 1,35 1,52 4.781}
{0 CHEMBL1592829,1 1,25 1,52 4.174}
{0 CHEMBL1597829,1 1,52 4.275}
{0 CHEMBL1598484,1 1,35 1,52 4.174}
{0 CHEMBL1604061,1 1,35 1,52 4.661}
{0 CHEMBL1705379,1 1,7 1,52 4.298}
{0 CHEMBL1705738,1 1,52 4.174}
{0 CHEMBL1725136,1 1,2 1,52 4.173}
{0 CHEMBL1725334,1 1,52 4.535}
{0 CHEMBL1741388,1 1,21 1,35 1,52 4.764}
{0 CHEMBL1868777,1 1,35 1,52 4.265}
{0 CHEMBL1874598,1 1,35 1,52 4.174}
{0 CHEMBL1879359,1 1,52 4.174}
{0 CHEMBL1887461,1 1,35 1,50 1,52 4.174}
{0 CHEMBL2029048,1 1,52 7.943}
{0 CHEMBL2130789,1 1,24 1,38 1,49 1,52 4.174}
{0 CHEMBL2145165,1 1,52 4.91}
{0 CHEMBL329691,1 1,26 1,33 1,52 4}
{0 CHEMBL98987,1 1,2 1,52 4.456}