On Target PERM_HUMAN 0.32222223/CHEMBL2347029
For the given ligand Sitagliptin, we have found in our database that, being scored 0.32222223, the most similar ligand is CHEMBL2347029. Check out the elaboration below.
| Sitagliptin (Given Ligand) | CHEMBL2347029 (Similar Ligand) |
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| N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc3cc(F)c(F)cc3F | CCNC(=O)CCCc1c[nH]c2ccc(F)cc12 |
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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 | 00010002 01000800 00100102 42810610 00041100 00000030 00002000 20000000 00500800 000808c0 08300004 40019000 0c008802 00601800 00000040 00040005 00000000 02000080 00200400 00100201 40000100 18008608 20800000 80500018 00042000 80000000 08000000 10000001 00000000 00078003 00040200 00400620 |