On Target FAK2_HUMAN 0.49367088/CHEMBL5722989
For the given ligand Tofacitinib, we have found in our database that, being scored 0.49367088, the most similar ligand is CHEMBL5722989. Check out the elaboration below.
| Tofacitinib (Given Ligand) | CHEMBL5722989 (Similar Ligand) |
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| C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c2ncnc3[nH]ccc23 | CN(C)[C@@H]1CCC[C@H]1Nc1nc(Nc2ccc(C(=O)NC3CC3)cc2)ncc1C(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 | 00010002 01001801 001001a0 88090610 22000008 20006040 0000a800 02101880 00000100 00000ad0 00200004 40019000 04008802 0100a000 00020c40 001c0006 00240020 12004000 08400000 50a00201 48180000 3e068620 20804840 0050005e 00040004 c0000000 00000000 900110c0 08008118 01460801 e0041000 000002c0 |