On Target PTN22_HUMAN 0.28994083/CHEMBL1320181
For the given ligand Chlorogenic acid, we have found in our database that, being scored 0.28994083, the most similar ligand is CHEMBL1320181. Check out the elaboration below.
| Chlorogenic acid (Given Ligand) | CHEMBL1320181 (Similar Ligand) |
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| O=C(/C=C/c1ccc(O)c(O)c1)O[C@@H]2C[C@](O)(C(=O)O)C[C@@H](O)[C@H]2O | CCOc1cc(/C=C(\C#N)C(=O)Nc2cccc(C(=O)O)c2)ccc1OCc1ccc(Br)cc1 |
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| 00050000 41000008 20000500 00010300 00280040 00000000 82000080 00000400 01800000 01000840 40000000 4010d000 0c00802a 02800000 00000002 00089008 00820400 02000100 3341a018 00020201 00000020 08000a00 05000001 08400010 00001400 80000000 00422000 40000420 00400200 0002010a 04020000 00000010 | 04004202 40008808 60100108 00210620 24001000 00084000 82040080 00000400 01800100 00400850 00280004 60129008 0080c012 00110080 01020043 12088008 20440400 02001100 08498000 80a20200 40100000 18020e20 60002401 00c01014 00040000 80002000 00522100 40010080 204a8200 000e0109 c4000008 08000380 |