On Target IKKB_HUMAN 0.36708862/CHEMBL3318321
For the given ligand Ibuprofen, we have found in our database that, being scored 0.36708862, the most similar ligand is CHEMBL3318321. Check out the elaboration below.
| Ibuprofen (Given Ligand) | CHEMBL3318321 (Similar Ligand) |
|---|---|
| CC(C)Cc1ccc(C(C)C(=O)O)cc1 | O[C@H]1CCC(=O)c2c(O)cccc12 |
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| 00000000 00000000 00000100 00010200 00000040 00000000 00000000 00000000 00000900 00080840 08100000 40009800 01008000 00000000 40040000 00080008 08000000 02000000 00000000 00000001 00000100 08000a00 01000000 00400010 00000000 80000000 00000000 00000000 00000000 00020002 00002000 00000400 | 00050000 4b000808 20000102 00010200 00080000 4002c000 02000000 00000201 00000900 00080840 08100000 40009840 04008002 00200000 00000000 00082008 00000200 02000000 00402000 00020201 00400500 08020360 01004000 00400014 00000000 80000201 00000000 00000000 00000002 00024002 c0000000 00400400 |