On Target NTRK1_HUMAN 0.2375/CHEMBL485556
For the given ligand Saxagliptin, we have found in our database that, being scored 0.2375, the most similar ligand is CHEMBL485556. Check out the elaboration below.
| Saxagliptin (Given Ligand) | CHEMBL485556 (Similar Ligand) |
|---|---|
| N#C[C@@H]2C[C@@H]1C[C@@H]1N2C(=O)[C@@H](N)C45CC3CC(CC(O)(C3)C4)C5 | CN(C(=O)C1CCCCC1)c2ccc3c(c2)nc(NC(=O)c4ccc(cc4)C#N)n3CCC(=O)N |
|
|
|
|
|
|
| 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 | 00014006 01800800 00180100 40090600 200e0068 00106000 00008000 02001000 00000100 208009c8 0938800c 40819000 8c009808 01f40000 002201c0 000c0004 00540000 0200400c 0ae02000 00a00005 c0100000 5c068630 21806c01 00700014 00000000 80000080 02000080 90000080 01008108 00461c01 c00e1000 000003c8 |