@relation QSAR-Dataset-from-ChEMBL17-for-Drug-Target-with-ChEMBL_ID:CHEMBL2146303 @attribute molecule_id {CHEMBL1299370,CHEMBL1299640,CHEMBL1301616,CHEMBL1304456,CHEMBL1305400,CHEMBL1307057,CHEMBL1307246,CHEMBL1310024,CHEMBL1310231,CHEMBL1321912,CHEMBL1322260,CHEMBL1332538,CHEMBL1334259,CHEMBL1337374,CHEMBL1337797,CHEMBL1344597,CHEMBL1351458,CHEMBL1354089,CHEMBL1374864,CHEMBL1375795,CHEMBL1376370,CHEMBL1386412,CHEMBL1387750,CHEMBL1390602,CHEMBL1392169,CHEMBL1392636,CHEMBL1393761,CHEMBL1399684,CHEMBL1401778,CHEMBL1402544,CHEMBL1404549,CHEMBL1406534,CHEMBL1408240,CHEMBL1408604,CHEMBL1414694,CHEMBL1419230,CHEMBL1420871,CHEMBL1425607,CHEMBL1427233,CHEMBL1429280,CHEMBL1429491,CHEMBL1430465,CHEMBL1435034,CHEMBL1435151,CHEMBL1442583,CHEMBL1450679,CHEMBL1453042,CHEMBL1453868,CHEMBL1456198,CHEMBL1462524,CHEMBL1468788,CHEMBL1473388,CHEMBL1477049,CHEMBL1480806,CHEMBL1489593,CHEMBL1490499,CHEMBL1493657,CHEMBL1499342,CHEMBL1501383,CHEMBL1505267,CHEMBL1505477,CHEMBL1506966,CHEMBL1507685,CHEMBL1510208,CHEMBL1511796,CHEMBL1516409,CHEMBL1517625,CHEMBL1521754,CHEMBL1527964,CHEMBL1531043,CHEMBL1534918,CHEMBL1543206,CHEMBL1547526,CHEMBL1548139,CHEMBL1548540,CHEMBL1559,CHEMBL1561800,CHEMBL1563531,CHEMBL1564510,CHEMBL1571530,CHEMBL1571768,CHEMBL1573024,CHEMBL1576749,CHEMBL1585220,CHEMBL1585840,CHEMBL1586704,CHEMBL1589389,CHEMBL1596456,CHEMBL1597054,CHEMBL1601180,CHEMBL1601445,CHEMBL1604118,CHEMBL1607007,CHEMBL1609696,CHEMBL1613237,CHEMBL1613664,CHEMBL1699206,CHEMBL1704528,CHEMBL1717951,CHEMBL1720465,CHEMBL1722377,CHEMBL1735542,CHEMBL1863802,CHEMBL1864123,CHEMBL1878837,CHEMBL1881623,CHEMBL1887158,CHEMBL1887425,CHEMBL1888226,CHEMBL1891426,CHEMBL1893648,CHEMBL1894665,CHEMBL1895142,CHEMBL1895166,CHEMBL1900755,CHEMBL1901922,CHEMBL1978037,CHEMBL1981667,CHEMBL1985345,CHEMBL2002487,CHEMBL2131743,CHEMBL2138701,CHEMBL2143436,CHEMBL512649,CHEMBL582471,CHEMBL582997,CHEMBL597857,CHEMBL91} @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 {16 1,26 1,52 4.588} {0 CHEMBL1299640,1 1,35 1,52 4.436} {0 CHEMBL1301616,1 1,35 1,50 1,52 4.397} {0 CHEMBL1304456,1 1,52 4.779} {0 CHEMBL1305400,1 1,35 1,52 4.612} {0 CHEMBL1307057,1 1,35 1,52 4.889} {0 CHEMBL1307246,1 1,6 1,26 1,35 1,49 1,52 4.981} {0 CHEMBL1310024,1 1,31 1,35 1,43 1,52 4.403} {0 CHEMBL1310231,1 1,4 1,52 4.841} {0 CHEMBL1321912,1 1,50 1,52 4.288} {0 CHEMBL1322260,1 1,35 1,52 4.496} {0 CHEMBL1332538,1 1,50 1,52 4.829} {0 CHEMBL1334259,1 1,35 1,52 4.853} {0 CHEMBL1337374,1 1,35 1,38 1,52 4.64} {0 CHEMBL1337797,1 1,52 4.959} {0 CHEMBL1344597,1 1,23 1,52 4.866} {0 CHEMBL1351458,1 1,35 1,52 4.403} {0 CHEMBL1354089,1 1,52 4.841} {0 CHEMBL1374864,1 1,35 1,52 4.944} {0 CHEMBL1375795,1 1,52 4.546} {0 CHEMBL1376370,1 1,35 1,43 1,52 4.269} {0 CHEMBL1386412,1 1,35 1,52 4.285} {0 CHEMBL1387750,1 1,35 1,43 1,52 4.929} {0 CHEMBL1390602,1 1,11 1,31 1,52 4.76} {0 CHEMBL1392169,1 1,35 1,52 4.629} {0 CHEMBL1392636,1 1,11 1,31 1,52 4.459} {0 CHEMBL1393761,1 1,2 1,50 1,52 4.301} {0 CHEMBL1399684,1 1,11 1,31 1,43 1,52 4.403} {0 CHEMBL1401778,1 1,45 1,49 1,52 4.841} {0 CHEMBL1402544,1 1,35 1,52 4.808} {0 CHEMBL1404549,1 1,52 4.873} {0 CHEMBL1406534,1 1,10 1,35 1,52 4.49} {0 CHEMBL1408240,1 1,35 1,52 4.495} {0 CHEMBL1408604,1 1,6 1,24 1,26 1,49 1,52 4.802} {0 CHEMBL1414694,1 1,23 1,52 4.479} {0 CHEMBL1419230,1 1,11 1,31 1,35 1,52 4.428} {0 CHEMBL1420871,1 1,8 1,31 1,35 1,52 4.667} {0 CHEMBL1425607,1 1,35 1,50 1,52 4.69} {0 CHEMBL1427233,1 1,35 1,52 4.718} {0 CHEMBL1429280,1 1,52 4.132} {0 CHEMBL1429491,1 1,2 1,33 1,52 4.672} {0 CHEMBL1430465,1 1,39 1,52 4.56} {0 CHEMBL1435034,1 1,2 1,24 1,35 1,52 4.985} {0 CHEMBL1435151,1 1,3 1,35 1,52 4.01} {0 CHEMBL1442583,1 1,4 1,6 1,24 1,50 1,52 4.276} {0 CHEMBL1450679,1 1,35 1,52 4.61} {0 CHEMBL1453042,1 1,31 1,35 1,52 4.837} {0 CHEMBL1453868,1 1,35 1,52 4.705} {0 CHEMBL1456198,1 1,26 1,50 1,52 4.434} {0 CHEMBL1462524,1 1,14 1,15 1,35 1,36 1,52 4.279} {0 CHEMBL1468788,1 1,52 4.908} {0 CHEMBL1473388,1 1,17 1,35 1,52 4.17} {0 CHEMBL1477049,1 1,19 1,31 1,46 1,52 4.651} {0 CHEMBL1480806,1 1,35 1,52 4.809} {0 CHEMBL1489593,1 1,11 1,52 4.085} {0 CHEMBL1490499,1 1,23 1,35 1,52 4.783} {0 CHEMBL1493657,1 1,24 1,35 1,39 1,52 4.477} {0 CHEMBL1499342,1 1,52 4.379} {0 CHEMBL1501383,1 1,35 1,45 1,52 4.408} {0 CHEMBL1505267,1 1,35 1,52 4.358} {0 CHEMBL1505477,1 1,52 4.431} {0 CHEMBL1506966,1 1,2 1,42 1,43 1,52 4.238} {0 CHEMBL1507685,1 1,2 1,35 1,52 4.316} {0 CHEMBL1510208,1 1,2 1,18 1,31 1,52 4.501} {0 CHEMBL1511796,1 1,35 1,52 4.932} {0 CHEMBL1516409,1 1,35 1,52 4.522} {0 CHEMBL1517625,1 1,35 1,52 4.862} {0 CHEMBL1521754,1 1,35 1,39 1,52 4.914} {0 CHEMBL1527964,1 1,35 1,52 4.283} {0 CHEMBL1531043,1 1,35 1,43 1,52 4.727} {0 CHEMBL1534918,1 1,35 1,52 4.304} {0 CHEMBL1543206,1 1,14 1,15 1,35 1,36 1,52 4.735} {0 CHEMBL1547526,1 1,35 1,52 4.695} {0 CHEMBL1548139,1 1,2 1,18 1,39 1,43 1,52 4.914} {0 CHEMBL1548540,1 1,35 1,52 4.868} {0 CHEMBL1559,1 1,50 1,52 4.918} {0 CHEMBL1561800,1 1,17 1,35 1,36 1,42 1,52 4.612} {0 CHEMBL1563531,1 1,31 1,35 1,38 1,52 4.056} {0 CHEMBL1564510,1 1,2 1,26 1,35 1,52 4.603} {0 CHEMBL1571530,1 1,35 1,52 4.794} {0 CHEMBL1571768,1 1,2 1,35 1,52 4.586} {0 CHEMBL1573024,1 1,23 1,35 1,52 4.593} {0 CHEMBL1576749,1 1,31 1,52 4.083} {0 CHEMBL1585220,1 1,35 1,52 4.33} {0 CHEMBL1585840,1 1,11 1,35 1,52 4.778} {0 CHEMBL1586704,1 1,24 1,35 1,43 1,52 4.785} {0 CHEMBL1589389,1 1,35 1,43 1,52 4.759} {0 CHEMBL1596456,1 1,35 1,52 4.352} {0 CHEMBL1597054,1 1,35 1,52 4.954} {0 CHEMBL1601180,1 1,31 1,52 4.55} {0 CHEMBL1601445,1 1,47 1,52 4.666} {0 CHEMBL1604118,1 1,2 1,18 1,35 1,52 4.57} {0 CHEMBL1607007,1 1,35 1,52 4.747} {0 CHEMBL1609696,1 1,35 1,43 1,52 4.882} {0 CHEMBL1613237,1 1,35 1,43 1,52 4.945} {0 CHEMBL1613664,1 1,8 1,52 4.807} {0 CHEMBL1699206,1 1,35 1,52 4.766} {0 CHEMBL1704528,1 1,15 1,26 1,52 4.904} {0 CHEMBL1717951,1 1,52 4.708} {0 CHEMBL1720465,1 1,2 1,18 1,35 1,49 1,52 4.698} {0 CHEMBL1722377,1 1,2 1,43 1,52 4.359} {0 CHEMBL1735542,1 1,2 1,5 1,35 1,52 4.635} {0 CHEMBL1863802,1 1,52 4.814} {0 CHEMBL1864123,1 1,6 1,49 1,52 4.658} {0 CHEMBL1878837,1 1,52 4.977} {0 CHEMBL1881623,1 1,5 1,35 1,52 4.783} {0 CHEMBL1887158,1 1,52 4.618} {0 CHEMBL1887425,1 1,7 1,24 1,27 1,52 4.298} {0 CHEMBL1888226,1 1,35 1,50 1,52 4.768} {0 CHEMBL1891426,1 1,2 1,26 1,35 1,50 1,52 4.828} {0 CHEMBL1893648,1 1,52 4.822} {0 CHEMBL1894665,1 1,52 4.988} {0 CHEMBL1895142,1 1,11 1,31 1,52 4.428} {0 CHEMBL1895166,1 1,2 1,18 1,52 4.738} {0 CHEMBL1900755,1 1,6 1,16 1,26 1,35 1,52 4.727} {0 CHEMBL1901922,1 1,52 4.848} {0 CHEMBL1978037,1 1,24 1,39 1,52 4.795} {0 CHEMBL1981667,1 1,31 1,39 1,50 1,52 4.6} {0 CHEMBL1985345,1 1,50 1,52 4.765} {0 CHEMBL2002487,1 1,28 1,31 1,39 1,43 1,52 4.712} {0 CHEMBL2131743,1 1,7 1,24 1,52 4.663} {0 CHEMBL2138701,1 1,52 4.914} {0 CHEMBL2143436,1 1,31 1,52 4.748} {0 CHEMBL512649,1 1,4 1,52 4.429} {0 CHEMBL582471,1 1,26 1,52 4.661} {0 CHEMBL582997,1 1,24 1,31 1,39 1,52 4.625} {0 CHEMBL597857,1 1,2 1,35 1,52 4.945} {0 CHEMBL91,1 1,50 1,52 4.911}