On Target IKKB_HUMAN 0.425/CHEMBL4061406
For the given ligand Etoricoxib, we have found in our database that, being scored 0.425, the most similar ligand is CHEMBL4061406. Check out the elaboration below.
| Etoricoxib (Given Ligand) | CHEMBL4061406 (Similar Ligand) |
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| Cc3ccc(c1ncc(Cl)cc1c2ccc(S(C)(=O)=O)cc2)cn3 | CS(=O)(=O)c1ccc(cc1)c2nc(N)nc3[nH]cc(C#N)c23 |
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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 | 0000a002 00801a00 800a0100 08d50610 010c1004 00004000 00002000 0008080c 00000100 00810840 00002004 60009800 82000800 00110000 80220000 080c000c 0c420000 02003044 04e00000 40202002 c0000000 0c028060 30802c40 0a60010d 00040000 80000000 08000000 00000061 0040400c 00460000 c0000a00 000106a0 |