On Target IKKB_HUMAN 0.42465752/CHEMBL1992922
For the given ligand Tofacitinib, we have found in our database that, being scored 0.42465752, the most similar ligand is CHEMBL1992922. Check out the elaboration below.
| Tofacitinib (Given Ligand) | CHEMBL1992922 (Similar Ligand) |
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| C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c2ncnc3[nH]ccc23 | OCC(CO)Nc1ncnc2[nH]cc(-c3ccccc3)c12 |
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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 | 00016002 00800800 40083100 080d0610 00081080 04004008 00008000 00000800 00000100 00000850 00200004 60009000 05001800 00000000 00000000 900c000c 00060000 02004008 0d600000 40200004 40100000 08068060 33804040 0040001c 00040001 80080000 08008200 000000c0 00014008 00460000 c0001200 000006e0 |