On Target CCR5_HUMAN 0.3006536/CHEMBL64591
For the given ligand Ferulic acid, we have found in our database that, being scored 0.3006536, the most similar ligand is CHEMBL64591. Check out the elaboration below.
| Ferulic acid (Given Ligand) | CHEMBL64591 (Similar Ligand) |
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| COc1cc(/C=C/C(=O)O)ccc1O | Cc1ccc(-c2ccc3c(c2)C=C(C(=O)Nc2ccc(C[N+]4(C)CCCCC4)cc2)CO3)cc1.[I-] |
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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 | 04006202 01008828 20100108 80010600 20201001 02200000 82040080 22001400 05800104 004008c0 40280004 70019008 16808812 00118000 01020443 00082008 20260400 22009100 1c818018 10820201 40140000 18008600 310820a0 00500010 00001000 c0000000 00422000 d00104c1 0040c300 00260001 24240000 00000252 |