On Target COMT_HUMAN 0.33333334/CHEMBL3818719
For the given ligand VBJ103, we have found in our database that, being scored 0.33333334, the most similar ligand is CHEMBL3818719. Check out the elaboration below.
| VBJ103 (Given Ligand) | CHEMBL3818719 (Similar Ligand) |
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| O=C(NC2CCC1(CCCC1)CC2)c4ccc(c3ccccc3)cc4 | CCN(CC)C(=O)c1cc2cc(O)c(O)c([N+](=O)[O-])c2cc1C(=O)N(CC)CC |
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| 00002000 01001800 00100100 40010600 00000000 00000000 00000000 22001000 00000100 000008c0 00200000 40018000 80008802 00000000 00000400 00000000 00020000 02000000 06002000 10000201 00000000 18068610 10000000 0050001c 00000000 c0000000 00000000 90000040 00004100 01060001 a0060000 00000200 | 00000012 80000818 20000100 90010600 00000000 00008000 02002080 02001000 14000000 00000860 04200004 40008000 00018a02 00200000 20100540 0000c118 00000000 02000000 00100000 00020600 40020000 08028688 20000000 0040100c 00000000 c0000000 00004000 80008010 01400100 00060001 80040000 04000200 |