On Target ACES_HUMAN 0.4127907/CHEMBL1080631
For the given ligand Pimecrolimus, we have found in our database that, being scored 0.4127907, the most similar ligand is CHEMBL1080631. Check out the elaboration below.
| Pimecrolimus (Given Ligand) | CHEMBL1080631 (Similar Ligand) |
|---|---|
| CC[C@@H]3/C=C(C)\C[C@H](C)C[C@H](OC)[C@H]4O[C@@](O)(C(=O)C(=O)N1CCCC[C@H]1C(=O)O[C@H](/C(C)=C/[C@@H]2CC[C@H](Cl)[C@H](OC)C2)C(C)[C@@H](O)CC3=O)[C@H](C)C[C@@H]4OC | CCCCCCOC(=O)[C@H](CCC(=O)NCCC1CCN(Cc2ccccc2)CC1)NC(=O)c3ccccc3 |
|
|
|
|
|
|
| 000f0040 81005000 00900100 80810700 823c00c0 00200800 02002840 28000442 04002040 011000a8 40202000 5001f000 1602802a 02880002 80081408 28289008 10a20000 80000000 33c02010 00002201 00000120 10040f10 17008080 0810001c 10201401 08000400 00c04000 b0000021 00800200 0004000b 24224000 00822a10 | 00038048 01005800 00100100 80010700 00080080 00000000 00000000 22001000 00200000 000208c0 00200000 5003b000 06008832 01800000 00001408 00081008 10820000 02000000 00402000 00000201 00000020 18068e20 13000000 0050001c 10000400 c0000000 00800000 90000001 00000300 00060003 a0044000 00802200 |