On Target ACM4_HUMAN 0.3223684/CHEMBL40391
For the given ligand Etoricoxib, we have found in our database that, being scored 0.3223684, the most similar ligand is CHEMBL40391. Check out the elaboration below.
| Etoricoxib (Given Ligand) | CHEMBL40391 (Similar Ligand) |
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| Cc3ccc(c1ncc(Cl)cc1c2ccc(S(C)(=O)=O)cc2)cn3 | Nc1cccc(n1)c2ccc(CCN3CCN(CC(=O)c4ccccc4)CC3)cc2 |
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| 0002a002 00811201 00024100 10910210 00041020 04000008 01000001 00480004 00000100 10000850 0000a084 60008810 06004808 00210000 a0220000 820c0004 04020000 02003004 04200008 10402006 c0000000 08008100 31800000 08400009 00040803 80080200 08040240 00000060 0040c004 00020400 00000820 01030020 | 00002002 00000800 80104100 14010600 01040020 00000000 00000000 00080000 00000180 10080840 08208004 4000a800 02008802 00002001 00020000 02040004 00020000 02002000 04200000 10600200 40000000 3c228200 30800821 83600014 00000000 80000000 000000c0 00000060 0c40400c 00060402 80004800 00000600 |