On Target PLK1_HUMAN 0.4300518/CHEMBL485295
For the given ligand Celecoxib, we have found in our database that, being scored 0.4300518, the most similar ligand is CHEMBL485295. Check out the elaboration below.
| Celecoxib (Given Ligand) | CHEMBL485295 (Similar Ligand) |
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| Cc3ccc(c1cc(C(F)(F)F)nn1c2ccc(S(N)(=O)=O)cc2)cc3 | Cc1nn(-c2cccc(S(C)(=O)=O)c2)c2cc(N[C@@H](C)c3ccccc3)ncc12 |
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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 | 00005006 00800e08 200a4100 00910600 010c0204 00024002 02002000 02061000 00000104 200908c0 49202005 6001c000 80000827 18800000 802001c0 000c200c 04240000 02804000 08600000 00a22000 c0100000 1c018020 20810844 8b602019 00102001 80000080 000600c0 80000880 0440810c 0046080a 40061000 800146e0 |