On Target PRGR_HUMAN 0.3/CHEMBL503848
For the given ligand Saxagliptin, we have found in our database that, being scored 0.3, the most similar ligand is CHEMBL503848. Check out the elaboration below.
| Saxagliptin (Given Ligand) | CHEMBL503848 (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 | C[C@H]1C[C@H]2[C@@H]3CCC4=CC(=O)C=C[C@]4(C)[C@@]3(F)[C@@H](O)C[C@]2(C)[C@@]1(OC(=O)NC5CCCCC5)C(=O)CO |
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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 | 00010002 81401000 00100100 00091700 00281480 00008000 00000080 82000402 01000200 01100080 00200000 4001d000 04028028 00800100 00000400 001a0008 00820000 80080000 13412800 00022001 00000001 10040ed0 01008000 00520818 00200000 00001002 00404020 90200000 00000200 0304000b a4020000 02000200 |