On Target DRB1_HUMAN 0.2722513/CHEMBL79025
For the given ligand Celecoxib, we have found in our database that, being scored 0.2722513, the most similar ligand is CHEMBL79025. Check out the elaboration below.
| Celecoxib (Given Ligand) | CHEMBL79025 (Similar Ligand) |
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| Cc3ccc(c1cc(C(F)(F)F)nn1c2ccc(S(N)(=O)=O)cc2)cc3 | Cc1ccc(S(=O)(=O)N[C@@H](Cc2ccccc2)C(=O)N[C@H](C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(N)=O)C(C)C)cc1 |
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| 00006036 00802208 a1100100 00b10600 01080010 00004002 00440400 00001400 00000104 000108f0 0900a004 6000800a 00000810 02000201 80200040 000c200c 00020000 02801000 04400000 10222008 c0100000 1801a020 30800800 8b404008 00000000 c0000040 30c20000 90000869 04004104 20460008 40260200 800126a2 | 000100d0 21803200 01100100 05b10600 00088008 00000000 00030000 20000008 00000800 004808c0 08302000 6001b000 06008003 00002001 80200000 00048000 00002000 02000000 00600008 00006601 80040100 38040601 00000003 bb400038 02000800 80000004 00000000 1000002c 0c000400 2006000b 20004002 00012660 |