On Target NFKB1_HUMAN 0.2881356/CHEMBL336099
For the given ligand Tofacitinib, we have found in our database that, being scored 0.2881356, the most similar ligand is CHEMBL336099. Check out the elaboration below.
| Tofacitinib (Given Ligand) | CHEMBL336099 (Similar Ligand) |
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| C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c2ncnc3[nH]ccc23 | O=C(Nc1cc(Cl)nc(Cl)n1)c1cnc(Cl)nc1C(F)(F)F |
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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 | 10018022 05000800 02100106 190c0610 00100000 0000c000 0000c400 00001800 00200100 00000030 48380004 40001880 07008004 00300001 40120600 040c0004 00040000 02004004 00402000 40204000 84120400 00240f00 21814040 00000118 00040000 40080380 00080000 90004080 0000000c 00460001 c0223020 804213e0 |