@relation QSAR-Dataset-from-ChEMBL17-for-Drug-Target-with-ChEMBL_ID:CHEMBL3771

@attribute molecule_id {CHEMBL104662,CHEMBL104680,CHEMBL104823,CHEMBL105989,CHEMBL106244,CHEMBL106641,CHEMBL106921,CHEMBL107064,CHEMBL107078,CHEMBL107126,CHEMBL107357,CHEMBL107963,CHEMBL108055,CHEMBL108677,CHEMBL120448,CHEMBL120853,CHEMBL121931,CHEMBL122071,CHEMBL122115,CHEMBL122199,CHEMBL122296,CHEMBL122575,CHEMBL122731,CHEMBL122963,CHEMBL122983,CHEMBL123060,CHEMBL123109,CHEMBL123391,CHEMBL123455,CHEMBL123457,CHEMBL123589,CHEMBL123989,CHEMBL123991,CHEMBL124107,CHEMBL124172,CHEMBL124175,CHEMBL134973,CHEMBL136258,CHEMBL137649,CHEMBL137847,CHEMBL138045,CHEMBL138087,CHEMBL138141,CHEMBL138211,CHEMBL138333,CHEMBL138346,CHEMBL138413,CHEMBL138427,CHEMBL138431,CHEMBL138754,CHEMBL138762,CHEMBL138876,CHEMBL139154,CHEMBL139315,CHEMBL139395,CHEMBL139405,CHEMBL139571,CHEMBL139958,CHEMBL140485,CHEMBL140884,CHEMBL141311,CHEMBL141639,CHEMBL141684,CHEMBL141812,CHEMBL2115030,CHEMBL2115461,CHEMBL263736,CHEMBL263745,CHEMBL265046,CHEMBL285920,CHEMBL286322,CHEMBL287467,CHEMBL288793,CHEMBL292678,CHEMBL293262,CHEMBL293304,CHEMBL293782,CHEMBL293998,CHEMBL295394,CHEMBL295494,CHEMBL296157,CHEMBL297341,CHEMBL298136,CHEMBL298178,CHEMBL298940,CHEMBL298960,CHEMBL299043,CHEMBL299063,CHEMBL299204,CHEMBL299278,CHEMBL299435,CHEMBL299924,CHEMBL300182,CHEMBL301610,CHEMBL301715,CHEMBL301787,CHEMBL305708,CHEMBL317213,CHEMBL317816,CHEMBL320474,CHEMBL32166,CHEMBL32171,CHEMBL322676,CHEMBL323736,CHEMBL32486,CHEMBL32559,CHEMBL326888,CHEMBL32918,CHEMBL331182,CHEMBL331210,CHEMBL331459,CHEMBL332366,CHEMBL332411,CHEMBL333117,CHEMBL333186,CHEMBL333256,CHEMBL333734,CHEMBL333761,CHEMBL334176,CHEMBL335147,CHEMBL336034,CHEMBL336230,CHEMBL336909,CHEMBL337146,CHEMBL337312,CHEMBL341422,CHEMBL341583,CHEMBL341767,CHEMBL341768,CHEMBL342014,CHEMBL342043,CHEMBL342631,CHEMBL342871,CHEMBL343116,CHEMBL343130,CHEMBL343154,CHEMBL343974,CHEMBL343989,CHEMBL344039,CHEMBL344166,CHEMBL344199,CHEMBL344256,CHEMBL344365,CHEMBL344424,CHEMBL344631,CHEMBL344656,CHEMBL345042,CHEMBL345088,CHEMBL35353,CHEMBL35762,CHEMBL35797,CHEMBL36010,CHEMBL36353,CHEMBL417361,CHEMBL417540,CHEMBL421075,CHEMBL421093,CHEMBL421758,CHEMBL422106,CHEMBL423909,CHEMBL431337,CHEMBL432637,CHEMBL433040,CHEMBL433457,CHEMBL436413,CHEMBL440297,CHEMBL440672,CHEMBL442168,CHEMBL442199,CHEMBL446658,CHEMBL45799,CHEMBL45899,CHEMBL47429,CHEMBL479921,CHEMBL48421,CHEMBL48639,CHEMBL49877,CHEMBL50073,CHEMBL50088,CHEMBL50095,CHEMBL50516,CHEMBL50745,CHEMBL50970,CHEMBL51153,CHEMBL51361,CHEMBL51470,CHEMBL51623,CHEMBL52599,CHEMBL542448,CHEMBL54930,CHEMBL55390,CHEMBL55962,CHEMBL56020,CHEMBL56153,CHEMBL56210,CHEMBL56307,CHEMBL56361,CHEMBL56516,CHEMBL56633,CHEMBL56642,CHEMBL56701,CHEMBL56741,CHEMBL56849,CHEMBL56901,CHEMBL57169,CHEMBL57465,CHEMBL57560,CHEMBL57561,CHEMBL57565,CHEMBL57617,CHEMBL58311,CHEMBL59252,CHEMBL59436,CHEMBL74483}
@attribute FCFP4_1024b38 numeric
@attribute FCFP4_1024b466 numeric
@attribute FCFP4_1024b359 numeric
@attribute FCFP4_1024b503 numeric
@attribute FCFP4_1024b33 numeric
@attribute FCFP4_1024b61 numeric
@attribute FCFP4_1024b908 numeric
@attribute FCFP4_1024b809 numeric
@attribute FCFP4_1024b983 numeric
@attribute FCFP4_1024b986 numeric
@attribute FCFP4_1024b283 numeric
@attribute FCFP4_1024b395 numeric
@attribute FCFP4_1024b574 numeric
@attribute FCFP4_1024b107 numeric
@attribute FCFP4_1024b453 numeric
@attribute FCFP4_1024b54 numeric
@attribute FCFP4_1024b1021 numeric
@attribute FCFP4_1024b781 numeric
@attribute FCFP4_1024b26 numeric
@attribute FCFP4_1024b949 numeric
@attribute FCFP4_1024b847 numeric
@attribute FCFP4_1024b815 numeric
@attribute FCFP4_1024b942 numeric
@attribute FCFP4_1024b981 numeric
@attribute FCFP4_1024b783 numeric
@attribute FCFP4_1024b385 numeric
@attribute FCFP4_1024b669 numeric
@attribute FCFP4_1024b816 numeric
@attribute FCFP4_1024b853 numeric
@attribute FCFP4_1024b114 numeric
@attribute FCFP4_1024b514 numeric
@attribute FCFP4_1024b922 numeric
@attribute FCFP4_1024b872 numeric
@attribute FCFP4_1024b508 numeric
@attribute FCFP4_1024b1010 numeric
@attribute FCFP4_1024b360 numeric
@attribute FCFP4_1024b634 numeric
@attribute FCFP4_1024b396 numeric
@attribute FCFP4_1024b650 numeric
@attribute FCFP4_1024b319 numeric
@attribute FCFP4_1024b57 numeric
@attribute FCFP4_1024b632 numeric
@attribute FCFP4_1024b275 numeric
@attribute FCFP4_1024b747 numeric
@attribute FCFP4_1024b964 numeric
@attribute FCFP4_1024b15 numeric
@attribute FCFP4_1024b227 numeric
@attribute FCFP4_1024b695 numeric
@attribute FCFP4_1024b1003 numeric
@attribute FCFP4_1024b826 numeric
@attribute FCFP4_1024b524 numeric
@attribute FCFP4_1024b454 numeric
@attribute FCFP4_1024b649 numeric
@attribute FCFP4_1024b902 numeric
@attribute FCFP4_1024b185 numeric
@attribute FCFP4_1024b233 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_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_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_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_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_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
{10 1,57 1,61 1,103 6.097}
{0 CHEMBL104680,10 1,11 1,14 1,15 1,16 1,23 1,57 1,61 1,86 1,103 5.658}
{0 CHEMBL104823,10 1,57 1,58 1,61 1,103 4.481}
{0 CHEMBL105989,15 1,16 1,57 1,103 5.432}
{0 CHEMBL106244,10 1,21 1,57 1,61 1,103 5.959}
{0 CHEMBL106641,12 1,15 1,16 1,21 1,57 1,101 1,103 4.959}
{0 CHEMBL106921,10 1,11 1,14 1,15 1,16 1,57 1,61 1,103 5.824}
{0 CHEMBL107064,10 1,21 1,57 1,61 1,80 1,103 5.854}
{0 CHEMBL107078,10 1,57 1,61 1,80 1,103 7.26}
{0 CHEMBL107126,10 1,15 1,16 1,57 1,61 1,103 7.854}
{0 CHEMBL107357,10 1,57 1,61 1,103 6.027}
{0 CHEMBL107963,10 1,11 1,14 1,15 1,16 1,57 1,61 1,103 5.62}
{0 CHEMBL108055,10 1,57 1,61 1,78 1,103 5.959}
{0 CHEMBL108677,10 1,11 1,14 1,15 1,16 1,57 1,61 1,103 7.215}
{0 CHEMBL120448,12 1,21 1,23 1,27 1,57 1,78 1,103 6.745}
{0 CHEMBL120853,7 1,10 1,21 1,25 1,35 1,36 1,37 1,43 1,44 1,57 1,103 4}
{0 CHEMBL121931,12 1,23 1,57 1,103 7.222}
{0 CHEMBL122071,7 1,10 1,12 1,13 1,21 1,25 1,43 1,44 1,52 1,57 1,103 4}
{0 CHEMBL122115,12 1,21 1,23 1,57 1,103 7}
{0 CHEMBL122199,12 1,23 1,57 1,103 5.824}
{0 CHEMBL122296,7 1,10 1,21 1,25 1,43 1,44 1,52 1,57 1,103 5.187}
{0 CHEMBL122575,7 1,10 1,21 1,25 1,35 1,36 1,37 1,43 1,44 1,57 1,103 4.699}
{0 CHEMBL122731,7 1,10 1,13 1,21 1,25 1,43 1,44 1,52 1,57 1,88 1,103 4}
{0 CHEMBL122963,7 1,10 1,12 1,13 1,21 1,25 1,43 1,44 1,52 1,57 1,103 4}
{0 CHEMBL122983,7 1,10 1,12 1,21 1,25 1,43 1,44 1,57 1,103 4.77}
{0 CHEMBL123060,12 1,33 1,57 1,103 4.469}
{0 CHEMBL123109,12 1,15 1,21 1,57 1,103 6.745}
{0 CHEMBL123391,12 1,45 1,57 1,73 1,103 5}
{0 CHEMBL123455,7 1,10 1,11 1,14 1,15 1,16 1,21 1,43 1,44 1,52 1,57 1,103 4}
{0 CHEMBL123457,7 1,10 1,21 1,25 1,43 1,44 1,52 1,57 1,103 4}
{0 CHEMBL123589,7 1,10 1,11 1,14 1,15 1,16 1,21 1,43 1,44 1,52 1,57 1,103 4.066}
{0 CHEMBL123989,12 1,23 1,57 1,81 1,103 7}
{0 CHEMBL123991,12 1,21 1,23 1,57 1,103 4.469}
{0 CHEMBL124107,7 1,10 1,12 1,13 1,21 1,25 1,32 1,43 1,44 1,52 1,57 1,103 4.167}
{0 CHEMBL124172,12 1,23 1,57 1,103 4.469}
{0 CHEMBL124175,12 1,23 1,57 1,103 7}
{0 CHEMBL134973,5 1,7 1,10 1,11 1,12 1,13 1,14 1,15 1,16 1,21 1,22 1,27 1,30 1,31 1,33 1,38 1,42 1,46 1,47 1,48 1,49 1,51 1,57 1,103 6.337}
{0 CHEMBL136258,7 1,10 1,11 1,12 1,13 1,14 1,15 1,16 1,21 1,27 1,30 1,31 1,33 1,38 1,46 1,47 1,48 1,49 1,51 1,57 1,103 6.745}
{0 CHEMBL137649,7 1,10 1,12 1,13 1,21 1,27 1,38 1,46 1,47 1,48 1,51 1,57 1,58 1,103 7.481}
{0 CHEMBL137847,10 1,21 1,57 1,103 6.432}
{0 CHEMBL138045,10 1,12 1,13 1,21 1,50 1,57 1,86 1,103 4.721}
{0 CHEMBL138087,5 1,7 1,10 1,12 1,13 1,21 1,27 1,30 1,31 1,33 1,38 1,40 1,41 1,46 1,47 1,48 1,51 1,53 1,57 1,103 5.854}
{0 CHEMBL138141,5 1,7 1,10 1,11 1,12 1,13 1,14 1,15 1,16 1,21 1,27 1,30 1,31 1,33 1,38 1,40 1,41 1,42 1,46 1,47 1,48 1,49 1,51 1,53 1,57 1,66 1,103 6.444}
{0 CHEMBL138211,7 1,10 1,12 1,13 1,21 1,27 1,30 1,31 1,33 1,38 1,46 1,47 1,48 1,51 1,57 1,103 6.268}
{0 CHEMBL138333,7 1,10 1,12 1,13 1,21 1,27 1,30 1,31 1,33 1,38 1,46 1,47 1,48 1,51 1,57 1,103 7.102}
{0 CHEMBL138346,5 1,7 1,10 1,11 1,12 1,13 1,14 1,15 1,16 1,21 1,22 1,27 1,30 1,31 1,33 1,38 1,46 1,47 1,48 1,49 1,51 1,57 1,100 1,103 6.638}
{0 CHEMBL138413,5 1,7 1,10 1,11 1,12 1,13 1,14 1,15 1,16 1,21 1,27 1,30 1,31 1,33 1,38 1,40 1,41 1,46 1,47 1,48 1,49 1,51 1,53 1,57 1,103 6.187}
{0 CHEMBL138427,7 1,10 1,12 1,13 1,21 1,27 1,38 1,46 1,47 1,48 1,51 1,57 1,58 1,103 6.398}
{0 CHEMBL138431,7 1,10 1,11 1,12 1,13 1,14 1,15 1,16 1,21 1,27 1,30 1,31 1,33 1,38 1,46 1,47 1,48 1,49 1,51 1,57 1,103 5.06}
{0 CHEMBL138754,7 1,10 1,12 1,13 1,15 1,21 1,27 1,38 1,46 1,47 1,48 1,51 1,57 1,58 1,103 6.337}
{0 CHEMBL138762,5 1,7 1,10 1,11 1,12 1,13 1,14 1,15 1,16 1,21 1,22 1,27 1,30 1,31 1,33 1,38 1,42 1,46 1,47 1,48 1,49 1,51 1,57 1,103 6.678}
{0 CHEMBL138876,5 1,7 1,10 1,12 1,13 1,21 1,27 1,30 1,31 1,33 1,38 1,40 1,41 1,46 1,47 1,48 1,51 1,53 1,57 1,103 5.854}
{0 CHEMBL139154,7 1,10 1,11 1,12 1,13 1,14 1,15 1,16 1,21 1,23 1,27 1,30 1,31 1,33 1,38 1,42 1,46 1,47 1,48 1,49 1,51 1,57 1,103 6.658}
{0 CHEMBL139315,7 1,10 1,11 1,12 1,13 1,14 1,15 1,16 1,21 1,27 1,30 1,31 1,33 1,38 1,46 1,47 1,48 1,49 1,51 1,57 1,103 8.046}
{0 CHEMBL139395,2 1,7 1,9 1,10 1,12 1,13 1,14 1,15 1,16 1,21 1,23 1,27 1,30 1,31 1,33 1,38 1,46 1,47 1,48 1,49 1,51 1,57 1,103 6.187}
{0 CHEMBL139405,5 1,10 1,12 1,21 1,40 1,41 1,53 1,57 1,103 7.222}
{0 CHEMBL139571,7 1,10 1,11 1,12 1,13 1,14 1,15 1,16 1,21 1,27 1,30 1,31 1,33 1,38 1,46 1,47 1,48 1,49 1,51 1,57 1,103 6.523}
{0 CHEMBL139958,2 1,7 1,8 1,9 1,10 1,12 1,13 1,21 1,23 1,27 1,38 1,46 1,47 1,48 1,51 1,57 1,58 1,103 5.959}
{0 CHEMBL140485,10 1,12 1,21 1,23 1,57 1,103 7.538}
{0 CHEMBL140884,5 1,7 1,10 1,11 1,12 1,13 1,14 1,15 1,16 1,21 1,27 1,30 1,31 1,33 1,38 1,40 1,41 1,42 1,46 1,47 1,48 1,49 1,51 1,57 1,64 1,103 6.538}
{0 CHEMBL141311,10 1,12 1,21 1,27 1,57 1,103 6.585}
{0 CHEMBL141639,7 1,10 1,11 1,12 1,13 1,14 1,15 1,16 1,21 1,27 1,30 1,31 1,33 1,38 1,46 1,47 1,48 1,49 1,51 1,57 1,103 5.745}
{0 CHEMBL141684,10 1,12 1,21 1,57 1,58 1,78 1,103 7.387}
{0 CHEMBL141812,10 1,12 1,21 1,57 1,103 7.523}
{0 CHEMBL2115030,7 1,10 1,12 1,13 1,21 1,27 1,45 1,46 1,47 1,48 1,51 1,55 1,56 1,57 1,103 4.143}
{0 CHEMBL2115461,7 1,10 1,12 1,13 1,21 1,27 1,45 1,46 1,47 1,48 1,51 1,55 1,56 1,57 1,103 4}
{0 CHEMBL263736,7 1,10 1,12 1,13 1,21 1,25 1,27 1,43 1,44 1,57 1,103 5.886}
{0 CHEMBL263745,12 1,23 1,57 1,103 7.222}
{0 CHEMBL265046,10 1,12 1,21 1,57 1,103 7.509}
{0 CHEMBL285920,7 1,10 1,12 1,13 1,21 1,25 1,27 1,43 1,44 1,57 1,103 5.854}
{0 CHEMBL286322,7 1,10 1,12 1,13 1,21 1,25 1,27 1,43 1,44 1,57 1,103 5.187}
{0 CHEMBL287467,7 1,10 1,12 1,13 1,21 1,25 1,43 1,44 1,50 1,57 1,103 5.602}
{0 CHEMBL288793,7 1,10 1,12 1,13 1,21 1,25 1,43 1,44 1,45 1,57 1,61 1,65 1,103 4.125}
{0 CHEMBL292678,1 1,2 1,3 1,4 1,5 1,6 1,8 1,9 1,15 1,16 1,17 1,18 1,23 1,24 1,26 1,32 1,40 1,41 1,42 1,50 1,53 1,57 1,66 1,80 1,103 7.301}
{0 CHEMBL293262,1 1,2 1,5 1,8 1,9 1,11 1,14 1,15 1,16 1,23 1,35 1,36 1,37 1,39 1,40 1,41 1,53 1,57 1,103 8.553}
{0 CHEMBL293304,1 1,2 1,3 1,4 1,5 1,6 1,8 1,9 1,11 1,14 1,15 1,16 1,17 1,18 1,23 1,24 1,26 1,32 1,35 1,36 1,37 1,40 1,41 1,42 1,50 1,53 1,57 1,66 1,103 7.759}
{0 CHEMBL293782,1 1,2 1,3 1,4 1,5 1,6 1,8 1,9 1,11 1,14 1,15 1,16 1,17 1,18 1,23 1,24 1,26 1,32 1,40 1,41 1,42 1,50 1,53 1,57 1,66 1,103 8.081}
{0 CHEMBL293998,1 1,2 1,3 1,4 1,5 1,6 1,8 1,9 1,11 1,14 1,15 1,16 1,17 1,18 1,19 1,20 1,22 1,23 1,24 1,26 1,28 1,29 1,32 1,34 1,42 1,50 1,57 1,103 8.201}
{0 CHEMBL295394,7 1,8 1,9 1,10 1,12 1,13 1,21 1,23 1,27 1,38 1,46 1,47 1,48 1,51 1,57 1,58 1,103 5.854}
{0 CHEMBL295494,7 1,10 1,12 1,13 1,21 1,27 1,45 1,46 1,47 1,48 1,51 1,55 1,56 1,57 1,103 4.939}
{0 CHEMBL296157,7 1,10 1,12 1,13 1,21 1,27 1,45 1,46 1,47 1,48 1,51 1,55 1,56 1,57 1,103 5}
{0 CHEMBL297341,7 1,10 1,12 1,13 1,21 1,27 1,45 1,46 1,47 1,48 1,51 1,55 1,56 1,57 1,103 4.143}
{0 CHEMBL298136,7 1,10 1,12 1,13 1,21 1,25 1,27 1,30 1,31 1,33 1,38 1,46 1,47 1,48 1,51 1,57 1,103 4.301}
{0 CHEMBL298178,7 1,10 1,12 1,13 1,21 1,25 1,27 1,38 1,46 1,47 1,48 1,50 1,51 1,57 1,103 5.301}
{0 CHEMBL298940,6 1,7 1,10 1,12 1,13 1,21 1,23 1,27 1,38 1,46 1,47 1,48 1,51 1,57 1,58 1,103 5.658}
{0 CHEMBL298960,7 1,10 1,13 1,21 1,25 1,51 1,55 1,57 1,58 1,103 4.102}
{0 CHEMBL299043,1 1,2 1,3 1,4 1,5 1,6 1,8 1,9 1,11 1,14 1,15 1,16 1,17 1,18 1,19 1,20 1,22 1,23 1,24 1,26 1,28 1,29 1,32 1,34 1,40 1,41 1,42 1,50 1,53 1,57 1,103 8.495}
{0 CHEMBL299063,1 1,2 1,3 1,4 1,5 1,6 1,8 1,9 1,11 1,14 1,15 1,16 1,19 1,20 1,22 1,23 1,28 1,29 1,34 1,54 1,57 1,78 1,100 1,103 8.187}
{0 CHEMBL299204,7 1,8 1,9 1,10 1,12 1,13 1,21 1,23 1,27 1,38 1,46 1,47 1,48 1,51 1,57 1,58 1,103 4}
{0 CHEMBL299278,1 1,2 1,3 1,4 1,5 1,6 1,8 1,9 1,11 1,14 1,15 1,16 1,17 1,18 1,19 1,20 1,22 1,23 1,24 1,26 1,28 1,29 1,32 1,34 1,42 1,50 1,57 1,103 8.432}
{0 CHEMBL299435,7 1,8 1,9 1,10 1,12 1,13 1,21 1,23 1,27 1,38 1,46 1,47 1,48 1,51 1,57 1,58 1,103 6.469}
{0 CHEMBL299924,1 1,2 1,3 1,4 1,5 1,6 1,8 1,9 1,11 1,14 1,15 1,16 1,17 1,19 1,20 1,22 1,23 1,28 1,29 1,32 1,34 1,50 1,57 1,103 7.18}
{0 CHEMBL300182,7 1,10 1,12 1,13 1,21 1,23 1,27 1,38 1,46 1,47 1,48 1,51 1,57 1,58 1,78 1,103 5.854}
{0 CHEMBL301610,7 1,8 1,9 1,10 1,12 1,13 1,21 1,23 1,25 1,27 1,38 1,46 1,47 1,48 1,51 1,57 1,58 1,103 6.268}
{0 CHEMBL301715,7 1,10 1,12 1,13 1,21 1,27 1,38 1,46 1,47 1,48 1,51 1,57 1,58 1,103 4.187}
{0 CHEMBL301787,7 1,10 1,12 1,13 1,21 1,27 1,45 1,46 1,47 1,48 1,51 1,55 1,56 1,57 1,103 4.796}
{0 CHEMBL305708,7 1,10 1,13 1,21 1,25 1,35 1,36 1,37 1,43 1,44 1,57 1,103 4.301}
{0 CHEMBL317213,10 1,11 1,14 1,15 1,16 1,57 1,61 1,103 5.42}
{0 CHEMBL317816,9 1,15 1,16 1,57 1,75 1,103 5.699}
{0 CHEMBL320474,15 1,16 1,103 5.046}
{0 CHEMBL32166,7 1,10 1,12 1,13 1,21 1,25 1,27 1,43 1,44 1,57 1,103 6.523}
{0 CHEMBL32171,7 1,10 1,12 1,13 1,21 1,25 1,43 1,44 1,45 1,57 1,103 5.699}
{0 CHEMBL322676,10 1,11 1,14 1,15 1,16 1,57 1,61 1,103 7.347}
{0 CHEMBL323736,10 1,57 1,61 1,103 5.456}
{0 CHEMBL32486,7 1,10 1,12 1,13 1,21 1,25 1,43 1,44 1,57 1,103 5.721}
{0 CHEMBL32559,7 1,10 1,12 1,13 1,21 1,25 1,43 1,44 1,45 1,57 1,103 5.678}
{0 CHEMBL326888,10 1,15 1,16 1,57 1,61 1,80 1,103 6}
{0 CHEMBL32918,7 1,10 1,12 1,13 1,21 1,25 1,43 1,44 1,45 1,57 1,103 5.62}
{0 CHEMBL331182,12 1,23 1,57 1,103 6.699}
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