On Target IL2_HUMAN 0.4871795/CHEMBL6018017
For the given ligand Tofacitinib, we have found in our database that, being scored 0.4871795, the most similar ligand is CHEMBL6018017. Check out the elaboration below.
| Tofacitinib (Given Ligand) | CHEMBL6018017 (Similar Ligand) |
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| C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c2ncnc3[nH]ccc23 | CN1CCN(c2ccc(Nc3ncc(F)c(N[C@@H]4C[C@@H]5CCCN5C(C)(C)C4)n3)cc2C#N)CC1 |
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| 00014006 01803800 00180020 0c080600 20080000 00086000 00008000 20100808 00200100 00000280 00200004 50031000 04008802 00002000 00020000 101c0004 00440000 00004008 08600000 00200205 40100000 3a048660 60804441 0210001e 00000000 80000000 00008000 10000080 08000018 004e0001 c0001200 000026c0 | 00014002 01001401 00100320 0c090600 22080028 00106050 0000a000 20100880 00200100 00800bf0 00200004 50039800 04000002 00003000 00020040 000c0004 00640400 12004000 08c02000 10a00201 60180000 3c040010 20804d60 02500012 00040000 80000000 00000000 100110c0 08408018 00460c10 40021000 400022c0 |