On Target ADRB2_HUMAN 0.5625/CHEMBL1570111
For the given ligand Linagliptin, we have found in our database that, being scored 0.5625, the most similar ligand is CHEMBL1570111. Check out the elaboration below.
| Linagliptin (Given Ligand) | CHEMBL1570111 (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(Cc2ccc(Cl)cc2)C(=O)c3c1nc(N4CCN(CC4)c5ccccn5)n3C |
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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 | 0001c02e 00801a00 00284160 06010700 000c0040 0000c000 0000a000 00001800 06500100 a0000ae0 0c20800c 40019800 06009846 00c02000 00280080 101c000c 00840000 0208c000 08600000 00a00000 c0100100 7e008140 21804861 83700006 40042000 c0200000 60040080 00040080 0c00c018 00461808 c00c1000 82020680 |