On Target COMT_HUMAN 0.31410256/CHEMBL953
For the given ligand A26, we have found in our database that, being scored 0.31410256, the most similar ligand is CHEMBL953. Check out the elaboration below.
| A26 (Given Ligand) | CHEMBL953 (Similar Ligand) |
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| O=C(O)c1ccccc1NC(=O)/C=C/c3ccc(c2cccc(C(F)(F)F)c2)cc3 | CCN(CC)C(=O)\C(=C\c1cc(O)c(O)c(c1)[N+](=O)[O-])\C#N |
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| 10016202 00008800 00100100 00010600 00000001 00014040 80000480 00080400 01800100 00400850 00280084 6000900a 04008000 01110000 00020042 00080008 20060400 02001100 0c018000 10800008 41100000 08020e20 30002000 00400004 00004000 80000000 00402010 d00110c1 0040c000 00060001 c4100000 00000200 | 00000006 c0008018 20100100 00010620 00000004 00080000 82102080 00000400 15800000 00400860 04200004 40129000 00018202 00010000 20100142 0000c018 20400400 02000100 00018000 00820602 40020000 18000600 60000401 00401418 00040000 c0000000 004a2100 4001a000 00480000 000e0101 04000000 0c008280 |