On Target IKBA_HUMAN 0.27966103/CHEMBL4522930
For the given ligand Tofacitinib, we have found in our database that, being scored 0.27966103, the most similar ligand is CHEMBL4522930. Check out the elaboration below.
| Tofacitinib (Given Ligand) | CHEMBL4522930 (Similar Ligand) |
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| C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c2ncnc3[nH]ccc23 | CCC(F)(F)c1cc(N2CCC(S(C)(=O)=O)CC2)nc2sc(C(N)=O)c(N)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 | 00014042 1500a800 42104108 c1110648 201c000c 0001e000 0000c480 00109008 00400900 200850d0 00302204 50018884 8811883a 01450822 800230c0 0004040c 05050000 0200401c 08200010 04a0023d 44101100 5c0e86c2 20808a80 b2740014 0a066003 8c000000 40098180 90000084 08c08008 08060822 80349000 41c11e60 |