On Target AHR_HUMAN 0.35632184/CHEMBL1506957
For the given ligand Tofacitinib, we have found in our database that, being scored 0.35632184, the most similar ligand is CHEMBL1506957. Check out the elaboration below.
| Tofacitinib (Given Ligand) | CHEMBL1506957 (Similar Ligand) |
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| C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c2ncnc3[nH]ccc23 | Cc1ccc2cc3c(NC(=O)CC(C)C)nn(C)c3nc2c1 |
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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 | 00004007 00000c09 60104100 08050600 200c0000 00006004 02808000 00200800 00000100 100008c0 0038000c 40019000 84009826 00d00000 00020040 000c400c 00048000 02800000 08600000 00220001 c0100080 1c058638 21807847 82608010 00022401 80000000 200480c0 100008c0 00008008 00062001 40040500 00000260 |