On Target ACE_HUMAN 0.36466166/CHEMBL1242210
For the given ligand Linagliptin, we have found in our database that, being scored 0.36466166, the most similar ligand is CHEMBL1242210. Check out the elaboration below.
| Linagliptin (Given Ligand) | CHEMBL1242210 (Similar Ligand) |
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| CC#CCn2c(N1CCC[C@@H](N)C1)nc5c2c(=O)n(Cc4nc(C)c3ccccc3n4)c(=O)n5C | CN(Cc1nc2cccc(N3CCN(C)CC3)n2c1CO)[C@H]4CCCc5cccnc45 |
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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 | 1001400a 01005800 001041a2 1c800e10 01041160 00104000 0100e000 2a003803 00500b00 200c02c0 4931a004 40815800 04000882 00b02800 00060c40 021c010c 0806aa00 07804006 88202408 40a00201 40120100 7e01a820 21804822 02700116 00140000 c1000401 0800c0c0 90000080 0840811e 00c63802 e0041100 a0004680 |