On Target SC6A4_HUMAN 0.37037036/CHEMBL404145
For the given ligand Sitagliptin, we have found in our database that, being scored 0.37037036, the most similar ligand is CHEMBL404145. Check out the elaboration below.
| Sitagliptin (Given Ligand) | CHEMBL404145 (Similar Ligand) |
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| N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc3cc(F)c(F)cc3F | CCN(CC)C(=O)[C@]1(C[C@H]1CN)c2cccc(F)c2 |
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| 00010040 01002408 40102102 02010e00 01100600 00100016 08800800 28002401 00100900 001929e0 08310120 d4019800 0c009006 04201000 00020800 0008200c 0100d200 020000a2 00400000 00b61a01 00000103 38232600 21000001 83500418 00010010 c0000400 c0400000 90021001 0c344004 00068013 84200080 00400e00 | 00030000 01000200 00100102 02010600 00000000 00000010 00000000 20000000 00300880 000828c0 08300000 50039000 05008012 01201000 40000000 00000000 00000000 02000000 00000000 00000201 00000100 18200620 00000000 81500018 00000004 80000000 80000000 10000001 04300000 0006800b 00002000 00000600 |