On Target ALDR_HUMAN 0.5346535/CHEMBL319244
For the given ligand Rofecoxib, we have found in our database that, being scored 0.5346535, the most similar ligand is CHEMBL319244. Check out the elaboration below.
| Rofecoxib (Given Ligand) | CHEMBL319244 (Similar Ligand) |
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| CS(=O)(=O)c3ccc(/C2=C(c1ccccc1)/C(=O)OC2)cc3 | Oc1ccc(\C=C\C(=O)OCCc2ccccc2)cc1O |
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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 | 00040000 40000008 20000100 00010200 00000040 00000000 82000080 00000440 01800000 00080840 48000000 40108000 04008002 00000000 00040002 00088008 08020400 02000000 24018018 00020200 00010020 08000a00 01000001 00400010 00001400 80000000 00422000 40000400 00400200 00020102 04000000 00000410 |