On Target BACE1_HUMAN 0.5229358/CHEMBL256399
For the given ligand pmi, we have found in our database that, being scored 0.5229358, the most similar ligand is CHEMBL256399. Check out the elaboration below.
| pmi (Given Ligand) | CHEMBL256399 (Similar Ligand) |
|---|---|
| CCC4CN3CCC2(Nc1cccc(OC)c1C2=O)C3CC4/C(=C\OC)C(=O)OC | CCCCCOc1cc(cc(c1)C(=O)N[C@@H](Cc2ccccc2)[C@H](O)CN[C@@H](C)C(=O)NC3CCCCC3)N4CCCC4=O |
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| 10034002 81000e08 2010012a 14010700 20081000 00032050 03000000 20001600 11900800 00380be0 08300004 5001b0c0 8c00801a 09a02000 03020541 000c200a 90a64080 02000000 08452018 00022601 60100100 38220a10 21000001 83500417 00001000 c0000080 00001800 90001080 0c00c302 0006c01a a402d000 20822610 | 1402400a c5005c08 6010010a 04010700 34081080 0e002010 02000000 22001004 00900880 000809f0 08380004 4001b000 06808802 08302082 91124441 30082008 10840080 02000000 0a482000 00022601 40100100 382e8610 23002041 8354801c 00040000 c0000000 00000000 90000080 2c408300 00060013 a0044000 00822600 |