On Target NMDE2_HUMAN 0.33802816/CHEMBL3797704
For the given ligand Linagliptin, we have found in our database that, being scored 0.33802816, the most similar ligand is CHEMBL3797704. Check out the elaboration below.
| Linagliptin (Given Ligand) | CHEMBL3797704 (Similar Ligand) |
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| CC#CCn2c(N1CCC[C@@H](N)C1)nc5c2c(=O)n(Cc4nc(C)c3ccccc3n4)c(=O)n5C | CN1C(=O)N(C)c2cc3CC(CCCc3cc12)NCCCc4ccccc4 |
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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 | 00000002 01004a00 00100102 40050700 00044060 00004002 00000000 20000001 04100980 000808e0 0d30800c 40818000 18009002 00600000 00300060 000c0004 01000200 02800004 00602000 00000201 c0000100 18200030 21804001 81700010 00002000 c0000001 00000040 10000010 04400002 0046004a 40020000 000026a0 |