On Target NOS2_HUMAN 0.4251497/CHEMBL223045
For the given ligand Tofacitinib, we have found in our database that, being scored 0.4251497, the most similar ligand is CHEMBL223045. Check out the elaboration below.
| Tofacitinib (Given Ligand) | CHEMBL223045 (Similar Ligand) |
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| C[C@@H]1CCN(C(=O)CC#N)C[C@@H]1N(C)c2ncnc3[nH]ccc23 | CN(C)c1ccc(CNC(=O)CC2CCCCN2c2ccnc(-n3ccnc3)n2)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 | 00010002 01800c01 00101100 88090600 620000c8 00006000 0080a000 22101a00 00000100 000009e0 0022800c 70019000 0c00980b 00008100 00420440 000c0004 00048000 02804000 08402010 00200201 e0100020 1c048610 218048c0 0050001c 00101000 c0000000 08000000 900000c0 00008118 00460011 60061000 000062c0 |