On Target AOFB_HUMAN 0.44715446/CHEMBL1254624
For the given ligand Rofecoxib, we have found in our database that, being scored 0.44715446, the most similar ligand is CHEMBL1254624. Check out the elaboration below.
| Rofecoxib (Given Ligand) | CHEMBL1254624 (Similar Ligand) |
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| CS(=O)(=O)c3ccc(/C2=C(c1ccccc1)/C(=O)OC2)cc3 | O=C(Oc1ccc2OC(=O)Cc2c1)\C=C\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 | 04001000 42000028 20000108 00010200 00001041 02000000 82000080 00000640 01800000 00080840 48000000 40009000 07808202 20000080 41050003 00082018 08020400 02000000 04098018 00020200 00040000 08000a00 11000000 00400010 00001000 80000400 00482000 40010401 00400300 00020002 04002000 12000410 |