On Target PA_INFA 0.3553719/CHEMBL3600947
For the given ligand Rosmarinic acid, we have found in our database that, being scored 0.3553719, the most similar ligand is CHEMBL3600947. Check out the elaboration below.
| Rosmarinic acid (Given Ligand) | CHEMBL3600947 (Similar Ligand) |
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| O=C(/C=C/c1ccc(O)c(O)c1)OC(Cc2ccc(O)c(O)c2)C(=O)O | O=C(COc1ccc(F)cc1)c1ccc(O)c(O)c1O |
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| 00040000 42000008 20000500 00010200 00000041 40000000 82000080 00000440 01800800 00080840 48100000 4010d080 0c008002 00000000 00040002 00088008 08020400 82000000 24418018 00020201 00010120 08000a00 05000041 08400014 00001c00 80000000 00522000 40000420 00400200 00020102 04000000 02000410 | 04001001 42000808 20110109 02010200 00001041 02020010 02000000 00000240 00000000 00080840 08040000 4000c100 00808002 00001000 01040001 2008a008 08000000 82000000 04000000 00420a00 00000000 08020200 01001000 00400014 00000000 80000000 00120008 00000001 00000200 00028002 80000000 00000600 |