On Target CAH2_HUMAN 0.34597155/CHEMBL306510
For the given ligand Sitagliptin, we have found in our database that, being scored 0.34597155, the most similar ligand is CHEMBL306510. Check out the elaboration below.
| Sitagliptin (Given Ligand) | CHEMBL306510 (Similar Ligand) |
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| N[C@@H](CC(=O)N1CCn2c(C1)nnc2C(F)(F)F)Cc3cc(F)c(F)cc3F | CC(C)[C@H](NC(=O)N(C)Cc1ccccn1)C(=O)N[C@H](C[C@@H](O)[C@H](Cc2ccccc2)NC(=O)[C@@H](NC(=O)N(C)Cc3ccccn3)C(C)C)Cc4ccccc4 |
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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 01807000 00104102 14010e00 000c00a0 00100000 00000004 2200700f 00200880 000a08c0 09310004 4003b000 0400b802 00202000 001a0000 020c010c 10004010 02000000 00e02040 00000a01 c0000100 38358610 238000c1 83500018 00110001 80000000 00000040 90000000 0c001106 00060003 20064000 80006600 |