On Target PERM_HUMAN 0.58762884/CHEMBL2170247
For the given ligand Linagliptin, we have found in our database that, being scored 0.58762884, the most similar ligand is CHEMBL2170247. Check out the elaboration below.
| Linagliptin (Given Ligand) | CHEMBL2170247 (Similar Ligand) |
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| CC#CCn2c(N1CCC[C@@H](N)C1)nc5c2c(=O)n(Cc4nc(C)c3ccccc3n4)c(=O)n5C | CN1C(=O)NC(=O)c2c1nc(NCCN)n2CCCOc3ccccc3 |
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| 0001022e 01801800 00382160 92050700 804c2160 0000c002 0000b200 00100801 86600110 b00008e0 0d21800c 50039800 04009002 00d0a000 003a00c0 120c000c 00a00000 0208c000 00600000 00a00201 c0000100 7e000068 618858c1 02700194 50140000 c0200008 62000000 100c1000 0900401c 00465a00 c0081002 80004aa0 | 0401002e 00801808 20280048 02010700 00081060 0200c040 0200a000 00000800 06400100 a08008e0 0c20800c 40019000 04809002 00c02000 01280081 100c200c 00a00000 0008c000 00c00000 00a20000 80000100 7e000040 21804841 00700014 40040000 c0200000 62000200 00040000 09004218 00461800 c0081000 800002c8 |