On Target CNR1_HUMAN 0.33802816/CHEMBL361957
For the given ligand Rofecoxib, we have found in our database that, being scored 0.33802816, the most similar ligand is CHEMBL361957. Check out the elaboration below.
| Rofecoxib (Given Ligand) | CHEMBL361957 (Similar Ligand) |
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| CS(=O)(=O)c3ccc(/C2=C(c1ccccc1)/C(=O)OC2)cc3 | COc1ccc(cc1)S(=O)(=O)c2cc(OC)ccc2S(=O)(=O)c3ccc(cc3)[C@H](C)NC(=O)Cc4ccccc4 |
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| 00000040 00801200 00020100 00910200 00100040 00000000 80000080 00000440 01800000 00080840 48002100 60009000 05008000 00010000 c0240002 00080008 0c020410 02000000 44018018 00002000 80010020 18040a00 01800000 08400019 00001400 80000000 00402000 40000420 00400200 00020002 04002000 00810430 | 00800000 80805208 20120108 00910600 00061400 00040000 02000000 02041000 00000080 00080840 08202000 60009000 01008802 90010000 c1200601 00000208 04001000 02000000 00200400 00022200 80000000 182c8640 00800000 89400019 00800001 c0040000 00800020 800000a0 04000300 00060003 20042000 00010620 |