On Target PADI4_HUMAN 0.22171946/CHEMBL5829152
For the given ligand Ferulic acid, we have found in our database that, being scored 0.22171946, the most similar ligand is CHEMBL5829152. Check out the elaboration below.
| Ferulic acid (Given Ligand) | CHEMBL5829152 (Similar Ligand) |
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| COc1cc(/C=C/C(=O)O)ccc1O | COC(=O)/C=C/c1ccc(-c2ccc3cc(-c4nc5cc(C(=O)N6C[C@H](N)C[C@@H](F)C6)cc(OC)c5n4C)n(CC4CC4)c3n2)cc1 |
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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 | 0001e002 4500b808 60104108 10050600 000c1070 000060c4 86800280 2218140c 01a00110 b00118c0 4120800c 50078800 06009802 09d08003 012244c7 220c000c 00028408 1200200c 0c698018 10460205 c1100000 78068e30 31802001 c274811c 02005800 c1000200 00402060 d0000440 0840430d 04460c41 e40c9a00 002406b8 |