On Target XCT_HUMAN 0.16778524/CHEMBL5593128
For the given ligand Ferulic acid, we have found in our database that, being scored 0.16778524, the most similar ligand is CHEMBL5593128. Check out the elaboration below.
| Ferulic acid (Given Ligand) | CHEMBL5593128 (Similar Ligand) |
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| COc1cc(/C=C/C(=O)O)ccc1O | CCCCCCCCCCCC(=O)O[C@@]12C[C@@H](C)[C@]34C=C(C)[C@H](OC(=O)c5ccc(F)cc5)[C@@]3(O)[C@H](O)C(CO)=C[C@H](C4=O)[C@@H]1C2(C)C |
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| 00000000 40000008 20000108 00010200 00001000 00000000 82000080 00000400 01800000 00000840 00000000 40108000 0400c002 00000000 01000003 00088008 00000400 02000000 00098018 00020200 00000000 08000a00 00000001 00400000 00001000 80000000 00422000 40000000 00400200 00020100 04000000 00000100 | 00050040 81000800 82900d00 82010300 00380050 00004810 02000040 28000402 00000140 01108848 40000200 40009000 14028028 03811000 00200404 02081008 00820000 02000300 21402010 00102001 00000020 08020a20 05008000 08400014 00201480 80202400 00484200 80001021 00000200 0002800a e4020000 02800210 |