On Target PTN22_HUMAN 0.26553673/CHEMBL1390354
For the given ligand Tofacitinib, we have found in our database that, being scored 0.26553673, the most similar ligand is CHEMBL1390354. Check out the elaboration below.
| Tofacitinib (Given Ligand) | CHEMBL1390354 (Similar Ligand) |
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| C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c2ncnc3[nH]ccc23 | N#C/C(=C\c1ccc(OCc2ccc(Br)cc2)cc1)C(=O)Nc1cccc(C(=O)O)c1 |
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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 | 04004202 00008808 60100108 00010620 24001000 00084000 82040080 00000400 01800100 00400850 00280004 60029008 00808012 00110000 01020043 12080008 20440400 02001100 08018000 80a20000 40100000 18020e20 60002401 00c01014 00040000 80002000 00522100 40010080 204a8200 000e0001 c4000008 08000280 |