On Target PAR1_HUMAN 0.3739496/CHEMBL2322664
For the given ligand Linagliptin, we have found in our database that, being scored 0.3739496, the most similar ligand is CHEMBL2322664. Check out the elaboration below.
| Linagliptin (Given Ligand) | CHEMBL2322664 (Similar Ligand) |
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| CC#CCn2c(N1CCC[C@@H](N)C1)nc5c2c(=O)n(Cc4nc(C)c3ccccc3n4)c(=O)n5C | N[C@@H](Cc1ccccc1)C(=O)N2CCN(CC2)c3nc(nc(n3)n4c(nc5ccccc45)C(F)F)N6CCOCC6 |
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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 | 00010002 00002221 00103100 94010600 420400e0 00004000 00800800 20000a88 00008900 400818e0 0d32800c 4005b000 07009003 00402100 00721048 121c010c 10009040 02804000 00600008 00200201 c0000100 3a000630 738040a3 8340001e 00000c00 c0000100 00000000 91000040 0c00021c 0046080b c0003000 00000680 |