On Target COMT_HUMAN 0.20833333/CHEMBL1324
For the given ligand CBDCOOH, we have found in our database that, being scored 0.20833333, the most similar ligand is CHEMBL1324. Check out the elaboration below.
| CBDCOOH (Given Ligand) | CHEMBL1324 (Similar Ligand) |
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| C=C(C)[C@@H]1CC/C(C(=O)O)=C\[C@H]1c2c(O)cc(CCCCC)cc2O | Cc1ccc(cc1)C(=O)c2cc(O)c(O)c(c2)[N+](=O)[O-] |
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| 00010001 43000008 20000102 00010202 00090000 40800000 02000081 08000602 01040900 00980842 08100000 40409840 0402800a 00a00000 00000400 00082008 00000000 02100020 00612010 00020a01 00000100 08000a80 01008000 00400010 00201000 84004400 04404200 80000000 00000002 00024002 24020000 00010400 | 08000002 c2000818 20001101 40010200 00000000 00000000 02002000 01000000 14400100 00080860 0c000004 40008800 00018202 00000000 20100140 3000c018 00000000 02000000 00000000 00020600 40020000 08020200 20000000 00421414 00040000 e0000000 00120000 4000a000 80400080 00060002 80000000 24000400 |