On Target TLR4_HUMAN 0.31496063/CHEMBL4068003
For the given ligand Linagliptin, we have found in our database that, being scored 0.31496063, the most similar ligand is CHEMBL4068003. Check out the elaboration below.
| Linagliptin (Given Ligand) | CHEMBL4068003 (Similar Ligand) |
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| CC#CCn2c(N1CCC[C@@H](N)C1)nc5c2c(=O)n(Cc4nc(C)c3ccccc3n4)c(=O)n5C | Cn1c2C(=O)N(C(=Nc2c3cc(ccc13)c4ccccc4)SCC(=O)NC5CCCCC5)c6ccccc6 |
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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 | 0000200a 01801200 201841a0 08112702 000d0040 0000c060 00008102 20001000 06560100 420248e0 0130000c 40018000 00009806 00e40080 100c00c0 000c0004 0c020008 02008204 06602020 00000213 c0000080 18048678 31900841 85780018 22000000 90000000 2000c048 10040040 24604000 00460049 400c0200 022107c0 |