On Target CASP1_HUMAN 0.33333334/CHEMBL269599
For the given ligand Etoricoxib, we have found in our database that, being scored 0.33333334, the most similar ligand is CHEMBL269599. Check out the elaboration below.
| Etoricoxib (Given Ligand) | CHEMBL269599 (Similar Ligand) |
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| Cc3ccc(c1ncc(Cl)cc1c2ccc(S(C)(=O)=O)cc2)cn3 | CS(=O)(=O)c1c(F)cc(cc1F)c2cc(C(=O)N)c(Cl)nn2 |
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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 | 0000a000 44801208 a0320180 02910610 01080004 14000012 00404000 0010100c 02004001 00012840 00002000 f0009800 0201800a 08011000 80200800 0804200c 04220000 03001004 04200000 00222a03 80000800 0c008700 10800800 0840400d 00114000 80000280 18264000 00000061 10005004 00068000 80005200 01030220 |