On Target IKKA_HUMAN 0.45614034/CHEMBL2164420
For the given ligand Celecoxib, we have found in our database that, being scored 0.45614034, the most similar ligand is CHEMBL2164420. Check out the elaboration below.
| Celecoxib (Given Ligand) | CHEMBL2164420 (Similar Ligand) |
|---|---|
| Cc3ccc(c1cc(C(F)(F)F)nn1c2ccc(S(N)(=O)=O)cc2)cc3 | O=S(=O)(NCCO)c1ccc(-c2ccnc3[nH]c(C(F)(F)F)cc23)cc1 |
|
|
|
|
|
|
| 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 | 00002032 00801800 01104100 11b50600 000c0028 00004000 00000400 00000004 00040100 00000870 0d002004 60008800 80000800 03d08001 80320040 020c000c 00022000 02000004 04600000 10006002 c0000000 08028020 32900000 c8400148 02000000 c0000004 00000100 9000006c 00404404 20460000 40140200 000106e0 |