On Target OPRK_HUMAN 0.5120773/CHEMBL3597152
For the given ligand Pimecrolimus, we have found in our database that, being scored 0.5120773, the most similar ligand is CHEMBL3597152. Check out the elaboration below.
| Pimecrolimus (Given Ligand) | CHEMBL3597152 (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 | CC(C)C[C@H](NC(=O)[C@H](CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](C)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(=O)O)NC(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(=O)N)NC(=O)CCCNC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc3ccccc3)NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](N)Cc4ccc(O)cc4)[C@@H](C)O)C(=O)N |
|
|
|
|
|
|
| 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 | 00030040 01007608 20100100 84810700 803c00c0 00200000 02003800 2800004c 00202880 010a09e0 08300000 4003b000 1e00803a 03882001 80181008 002f9008 10a00040 02000001 11c0a018 00020201 00100120 382c0e30 17000083 8b500018 10001c01 80000000 00920000 34000021 0c000202 0006001b 20e04000 00802e00 |