On Target TNFA_HUMAN 0.32967034/CHEMBL306090
For the given ligand Sitagliptin, we have found in our database that, being scored 0.32967034, the most similar ligand is CHEMBL306090. Check out the elaboration below.
| Sitagliptin (Given Ligand) | CHEMBL306090 (Similar Ligand) |
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| N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc3cc(F)c(F)cc3F | CNC(=O)[C@@H](NC(=O)[C@@H]([C@H](CO)C(=O)NO)c1ccc(C)cc1)C(C)(C)C |
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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 | 00060000 00003210 40100100 04010600 00100000 00000000 08000000 20000008 00200980 000808c0 08300000 4002b800 17008016 00002000 c0000000 00080018 00000000 02000000 00c00008 00040201 00000100 38200600 01000041 83400018 00002800 80000000 00000000 10000000 0c000002 0006000f 20006000 02802e00 |