On Target ABCG2_HUMAN 0.47586206/CHEMBL5279701
For the given ligand Tofacitinib, we have found in our database that, being scored 0.47586206, the most similar ligand is CHEMBL5279701. Check out the elaboration below.
| Tofacitinib (Given Ligand) | CHEMBL5279701 (Similar Ligand) |
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| C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c2ncnc3[nH]ccc23 | c1ccc(CCN2CCN(c3ncnc4c3[nH]c3ccccc34)CC2)cc1 |
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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 | 0001400a 00800000 00100120 0c090620 00040040 0800c020 00008000 00000800 00400180 00080a40 09200004 40009000 04000802 00c02000 00040041 001c0004 08040000 02004000 08600000 00200200 40100000 3a248068 21804061 83400012 00000002 80100000 00008480 00000080 0c008018 00460002 40041200 000006c0 |