On Target ACM4_HUMAN 0.42753622/CHEMBL1180285
For the given ligand Rofecoxib, we have found in our database that, being scored 0.42753622, the most similar ligand is CHEMBL1180285. Check out the elaboration below.
| Rofecoxib (Given Ligand) | CHEMBL1180285 (Similar Ligand) |
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| CS(=O)(=O)c3ccc(/C2=C(c1ccccc1)/C(=O)OC2)cc3 | CCN1CCC(=C(C1)C(=O)OCCc2ccc(C)cc2)c3ccccc3 |
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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 | 00040050 08008200 00100100 00010600 00000040 00000800 82180180 30000440 01800900 005808c8 48300000 40009800 0c008102 00090000 00040002 000c0008 28220400 02000140 2481801a 00800201 00010120 18000a80 01008080 00400010 00001401 80000400 00482000 50010400 00400200 0006040a 04000000 00002610 |