On Target TLR4_HUMAN 0.5147059/CHEMBL2364541
For the given ligand Pimecrolimus, we have found in our database that, being scored 0.5147059, the most similar ligand is CHEMBL2364541. Check out the elaboration below.
| Pimecrolimus (Given Ligand) | CHEMBL2364541 (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 | [Na+].[Na+].[Na+].[Na+].CCCCCCCCCCCC(=O)CC(=O)N[C@H]1[C@@H](OP(=O)([O-])[O-])O[C@H](CO[C@@H]2O[C@H](OC)[C@@H](OP(=O)([O-])[O-])[C@H](OCC[C@@H](CCCCCCC)OC)[C@H]2NC(=O)CCCCCCCCC\C=C/CCCCCC)[C@@H](O)[C@@H]1OCCCCCCCCCC |
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| 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 | 00010040 01005000 00100510 81810f00 803800c5 00000000 00007800 28002442 00206100 011000a0 00200000 c0019000 0c02800a 038200a0 000a1408 00299e08 108e00e0 00000000 11c0a010 0000720b 00104020 14562e30 37008080 08100018 10221401 00000000 16c04200 bc010021 00000202 0004001d 25e20000 0000aa00 |