On Target BACE1_HUMAN 0.3488372/CHEMBL3586204
For the given ligand Mesalazine, we have found in our database that, being scored 0.3488372, the most similar ligand is CHEMBL3586204. Check out the elaboration below.
| Mesalazine (Given Ligand) | CHEMBL3586204 (Similar Ligand) |
|---|---|
| Nc1ccc(O)c(C(=O)O)c1 | C[C@@]12CC[C@@H]3[C@](C)(CC[C@H](OC(=O)c4ccc(O)cc4)[C@]3(C)C(=O)O)[C@H]1CC[C@@H]5[C@@]6(C)CC[C@@H](O)[C@](C)(CO)[C@@H]6C[C@H](O)[C@@]5(O)C2 |
|
|
|
|
|
|
| 00000002 00000808 20000100 00010200 00000000 00024000 02000000 00000800 00000100 00000840 00000004 40008000 00008002 00000000 00000040 10082008 00000000 02000000 00000000 80020000 40000000 08020a20 20000000 00400004 00040000 80000000 00040000 00000000 00400000 00060000 c0000000 00000000 | 00010000 01000808 20000101 00010300 000c0050 00204000 02000000 00000000 00000100 01000840 00000000 40009000 1400800a 02810000 00000000 02081008 00820000 02000000 03402000 00020001 00000020 08020a20 05000000 00400014 00000400 80002000 004a8000 00001000 00000200 0002000a c0020000 02000000 |