On Target AA2AR_HUMAN 0.29166666/CHEMBL217541
For the given ligand Saxagliptin, we have found in our database that, being scored 0.29166666, the most similar ligand is CHEMBL217541. Check out the elaboration below.
| Saxagliptin (Given Ligand) | CHEMBL217541 (Similar Ligand) |
|---|---|
| N#C[C@@H]2C[C@@H]1C[C@@H]1N2C(=O)[C@@H](N)C45CC3CC(CC(O)(C3)C4)C5 | CCCN1C(=O)N(CCC)c2[nH]c(nc2C1=O)[C@@]34CC[C@@](CC3)(CC4)C(=O)NCCN(C)C |
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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 | 0001002a 01803800 00180400 16010700 04080060 0000c440 01009000 20000408 16400100 800010a0 0c20800c 40811800 0400900a 00d02000 002a0080 080c100c 00800000 04008000 02402008 00000201 80100500 30000650 21800041 0230001c 00040000 c0200200 60000000 10040080 08004005 00c60801 c00a0000 60000288 |