On Target OPRD_HUMAN 0.34586465/CHEMBL129693
For the given ligand Rofecoxib, we have found in our database that, being scored 0.34586465, the most similar ligand is CHEMBL129693. Check out the elaboration below.
| Rofecoxib (Given Ligand) | CHEMBL129693 (Similar Ligand) |
|---|---|
| CS(=O)(=O)c3ccc(/C2=C(c1ccccc1)/C(=O)OC2)cc3 | CCN(CC)C(=O)c1ccc(cc1)C(=C2CCNCC2)c3ccc(SC)cc3 |
|
|
|
|
|
|
| 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 | 00000000 09801a00 00120300 40110600 00000000 00000000 80080080 03001400 00000100 001808c8 08200000 70018800 80008802 00010000 00000402 00000000 04000400 02000040 40000000 00000201 81000000 18068600 00808000 0040001d 01000000 e0000000 00402000 d0000000 00400180 00060c03 84040000 00010620 |