On Target NOS1_HUMAN 0.375/CHEMBL4084332
For the given ligand Etoricoxib, we have found in our database that, being scored 0.375, the most similar ligand is CHEMBL4084332. Check out the elaboration below.
| Etoricoxib (Given Ligand) | CHEMBL4084332 (Similar Ligand) |
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| Cc3ccc(c1ncc(Cl)cc1c2ccc(S(C)(=O)=O)cc2)cn3 | CNCc1ccc(cc1)c2cncc(CCc3cc(C)cc(N)n3)c2 |
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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 | 0200200a 00004800 00004100 10810610 01041024 04000008 10002000 02001000 00400900 000c0840 08308004 40808000 80000800 00008800 00820000 820c000c 00020000 06001004 04200408 10200003 40000100 0c108000 35800800 18600010 00040801 80080080 080002c0 80000041 0040410c 00860002 00040000 20000720 |