On Target PGH1_SHEEP 0.29181495/CHEMBL3331465
For the given ligand Linagliptin, we have found in our database that, being scored 0.29181495, the most similar ligand is CHEMBL3331465. Check out the elaboration below.
| Linagliptin (Given Ligand) | CHEMBL3331465 (Similar Ligand) |
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| CC#CCn2c(N1CCC[C@@H](N)C1)nc5c2c(=O)n(Cc4nc(C)c3ccccc3n4)c(=O)n5C | CC(C)C1=C(COC(=O)Cc2ccccc2Nc3c(Cl)cccc3Cl)N(C)N(C1=O)c4ccccc4 |
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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 | 04008006 42002208 20080180 00010710 01080052 0000c422 00142012 08001040 06802304 800d88c1 09210004 6000b800 03808804 20610400 40060840 020e200c 08878801 83808000 0c480102 00620000 400104a0 78018b68 a1805800 83700014 00002400 c0000600 020a0028 80081880 0c00838d 1866100a c0062000 a60206a0 |