On Target ESR1_HUMAN 0.42391303/CHEMBL1222035
For the given ligand Saxagliptin, we have found in our database that, being scored 0.42391303, the most similar ligand is CHEMBL1222035. Check out the elaboration below.
| Saxagliptin (Given Ligand) | CHEMBL1222035 (Similar Ligand) |
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| N#C[C@@H]2C[C@@H]1C[C@@H]1N2C(=O)[C@@H](N)C45CC3CC(CC(O)(C3)C4)C5 | CCCCN(C)C(=O)CCCCCCCCCC[C@@H]1Cc2cc(O)ccc2[C@H]3CC[C@]4(C)[C@@H](O)CC[C@H]4[C@H]13 |
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| 00010000 01001000 00100000 00000400 00180000 00000010 00000000 20000000 00000000 00000080 00200000 50013000 0400802a 01800000 00000000 00080008 00400000 00000000 02402000 00000201 00000000 30040610 03000401 02100018 00000000 00000000 00000100 10000000 08000000 00040001 00020000 00002380 | 00010000 43001008 20100102 00010600 00080000 40000002 02000000 20000001 00000800 000808c0 08300000 40019000 0400800a 00a00000 00000020 00080008 00000200 02000000 02402000 00020201 00000100 18040610 01004000 00500018 00000000 80000001 00120000 10000000 00000002 01060003 00020000 00002600 |