| Tofacitinib (Given Ligand) | CHEMBL1171856 (Similar Ligand) |
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| C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c2ncnc3[nH]ccc23 | CSc1nc(NCC2CCCCC2)c(C(=O)O)c(SCc2ccccc2)n1 |
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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 | 10011202 01001b00 00102520 2a192611 20000000 00036060 00019100 00101900 00820300 000048d0 01200004 60019020 24009002 40042000 10021000 000c400e 04040008 06004100 82402000 40200001 80100000 18448a10 20804041 00d8001c 00042000 90008000 00008800 10801080 00080008 00460008 d0021000 000102e0 |