On Target PTGES_HUMAN 0.44559586/CHEMBL3770411
For the given ligand Linagliptin, we have found in our database that, being scored 0.44559586, the most similar ligand is CHEMBL3770411. Check out the elaboration below.
| Linagliptin (Given Ligand) | CHEMBL3770411 (Similar Ligand) |
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| CC#CCn2c(N1CCC[C@@H](N)C1)nc5c2c(=O)n(Cc4nc(C)c3ccccc3n4)c(=O)n5C | CC(C)n1c(nc2cc(C)c(C)cc12)N3CCC(CC3)C(=O)NC4CCCC4 |
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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 | 00020006 01001800 00100100 00050600 000c0044 00004000 00000000 20100000 00200110 200008c0 0920800c 50039000 04009002 00600000 002000c0 000c0004 00000000 02804004 00600000 00a00201 c0000000 5c040630 21800801 00700018 00000000 80000000 02000040 10000000 01400008 01461841 40081000 008022a0 |