On Target PTN1_HUMAN 0.3838384/CHEMBL4641922
For the given ligand Celecoxib, we have found in our database that, being scored 0.3838384, the most similar ligand is CHEMBL4641922. Check out the elaboration below.
| Celecoxib (Given Ligand) | CHEMBL4641922 (Similar Ligand) |
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| Cc3ccc(c1cc(C(F)(F)F)nn1c2ccc(S(N)(=O)=O)cc2)cc3 | Cc1cc(C)n(-c2ccc(S(=O)(=O)Nc3ncccn3)cc2)c(=O)c1C#N |
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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 | 00000012 00882a00 01004100 10b00610 00041072 00004040 00002802 00001000 06100100 408108f0 04002004 60818000 80008800 00208201 80320040 022c000c 08402000 82800004 00e00100 00206001 c0000080 1e209010 20800cc5 8b700008 00040000 c0000040 08400660 0400085c 0440040c 30460048 40040000 000102e0 |