On Target PD2R2_HUMAN 0.23140496/CHEMBL2096774
For the given ligand Aucubin, we have found in our database that, being scored 0.23140496, the most similar ligand is CHEMBL2096774. Check out the elaboration below.
| Aucubin (Given Ligand) | CHEMBL2096774 (Similar Ligand) |
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| OC/C2=C/[C@@H](O)[C@@H]3/C=C\O[C@@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H]23 | CCCCC[C@](C)(O)/C=C/[C@H]1C(=O)C[C@H](O)[C@@H]1C/C=C/CCCC(=O)O |
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| 00000040 81000000 00000801 80010101 80290041 00000001 00022880 28010402 00200000 015000e8 08000200 40418010 80020002 02800000 02000404 012a9008 00800004 00000000 1141e010 00008201 00100020 00001090 0500a000 08100010 00201420 80201400 00404002 a4000020 00004240 00000000 14a00000 00000000 | 00050000 81000000 02800000 00000000 00080000 00000000 00000040 08000402 00000040 00108008 00000000 40001000 14028008 00800000 00000400 00080008 00000000 00000000 00402010 00002001 00000000 00000a00 01008000 00000010 00201000 00000400 00404200 80000000 00000000 01000000 24020000 00000000 |