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| Cheminformatic Tools and Databases for Pharmacology | ||||
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Framework analysis of results 1) Bioisostere 1 is the representative of the cluster containing 20 molecules with same framework (list of bioisosteres: 1 2 7 9 11 12 13 15 23 24 25 26 37 60 84 104 134 142 143 155) cluster-1.sdf 2) Bioisostere 3 is the representative of the cluster containing 49 molecules with same framework (list of bioisosteres: 3 6 10 14 16 17 18 20 28 30 31 33 34 35 38 47 54 55 57 58 62 64 67 72 74 77 79 87 93 94 95 105 109 111 114 119 121 122 123 128 132 135 139 141 148 156 158 161 170) cluster-2.sdf 3) Bioisostere 4 is the representative of the cluster containing 31 molecules with same framework (list of bioisosteres: 4 19 22 27 32 39 43 44 46 48 51 53 66 68 69 70 71 73 76 81 82 85 97 99 103 108 110 112 118 129 131) cluster-3.sdf 4) Bioisostere 5 is the representative of the cluster containing 13 molecules with same framework (list of bioisosteres: 5 8 21 40 59 78 86 92 116 120 137 164 168) cluster-4.sdf 5) Bioisostere 29 is the representative of the cluster containing 5 molecules with same framework (list of bioisosteres: 29 41 83 100 124) cluster-5.sdf 6) Bioisostere 36 is the representative of the cluster containing 3 molecules with same framework (list of bioisosteres: 36 52 133) cluster-6.sdf 7) Bioisostere 42 is the representative of the cluster containing 2 molecules with same framework (list of bioisosteres: 42 102) cluster-7.sdf 8) Bioisostere 45 is the representative of the cluster containing 2 molecules with same framework (list of bioisosteres: 45 61) cluster-8.sdf 9) Bioisostere 49 is the representative of the cluster containing 5 molecules with same framework (list of bioisosteres: 49 65 96 130 152) cluster-9.sdf 10) Bioisostere 50 is the representative of the cluster containing 7 molecules with same framework (list of bioisosteres: 50 89 98 106 107 117 151) cluster-10.sdf 11) Bioisostere 56 is the representative of the cluster containing 3 molecules with same framework (list of bioisosteres: 56 157 162) cluster-11.sdf 12) Bioisostere 63 is the representative of the cluster containing 3 molecules with same framework (list of bioisosteres: 63 136 169) cluster-12.sdf 13) Bioisostere 75 is the representative of the cluster containing 2 molecules with same framework (list of bioisosteres: 75 88) cluster-13.sdf 14) Bioisostere 80 is the representative of the cluster containing 7 molecules with same framework (list of bioisosteres: 80 125 126 138 145 147 166) cluster-14.sdf 15) Bioisostere 90 is the representative of the cluster containing 3 molecules with same framework (list of bioisosteres: 90 101 160) cluster-15.sdf 16) Bioisostere 91 is the representative of the cluster containing 2 molecules with same framework (list of bioisosteres: 91 167) cluster-16.sdf 17) Bioisostere 113 is the representative of the cluster containing 1 molecules with same framework (list of bioisosteres: 113) cluster-17.sdf 18) Bioisostere 115 is the representative of the cluster containing 1 molecules with same framework (list of bioisosteres: 115) cluster-18.sdf 19) Bioisostere 127 is the representative of the cluster containing 1 molecules with same framework (list of bioisosteres: 127) cluster-19.sdf 20) Bioisostere 140 is the representative of the cluster containing 2 molecules with same framework (list of bioisosteres: 140 163) cluster-20.sdf 21) Bioisostere 144 is the representative of the cluster containing 1 molecules with same framework (list of bioisosteres: 144) cluster-21.sdf 22) Bioisostere 146 is the representative of the cluster containing 1 molecules with same framework (list of bioisosteres: 146) cluster-22.sdf 23) Bioisostere 149 is the representative of the cluster containing 1 molecules with same framework (list of bioisosteres: 149) cluster-23.sdf 24) Bioisostere 150 is the representative of the cluster containing 2 molecules with same framework (list of bioisosteres: 150 165) cluster-24.sdf 25) Bioisostere 153 is the representative of the cluster containing 1 molecules with same framework (list of bioisosteres: 153) cluster-25.sdf 26) Bioisostere 154 is the representative of the cluster containing 1 molecules with same framework (list of bioisosteres: 154) cluster-26.sdf 27) Bioisostere 159 is the representative of the cluster containing 1 molecules with same framework (list of bioisosteres: 159) cluster-27.sdf
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