On Target S19A1_HUMAN 0.18224299/CHEMBL4447805
For the given ligand Chlorogenic acid, we have found in our database that, being scored 0.18224299, the most similar ligand is CHEMBL4447805. Check out the elaboration below.
| Chlorogenic acid (Given Ligand) | CHEMBL4447805 (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 | Nc1nc2[nH]c(CCOc3ccc(C(=O)N[C@@H](CCC(=O)O)C(=O)O)cc3)cc2c(=O)[nH]1 |
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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 | 0403920a 01805808 20181109 18010600 041810e0 02004000 02043000 22001840 06000100 800a08e0 00208004 6080b800 06808822 02700000 01060401 080c200c 18000800 0200c004 04600000 00220201 40000000 1c068e60 23804840 0070001c 02000000 c0000201 78220000 90040000 0040430c 00460003 e0444200 e0800e80 |