On Target GCR_HUMAN 0.37593985/CHEMBL4449005
For the given ligand Genipin, we have found in our database that, being scored 0.37593985, the most similar ligand is CHEMBL4449005. Check out the elaboration below.
| Genipin (Given Ligand) | CHEMBL4449005 (Similar Ligand) |
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| COC(=O)/C1=C/O[C@@H](O)[C@@H]2/C(CO)=C\C[C@H]12 | C#CCOC(=O)/C(C)=C(C)\C=C\[C@](C)(O)[C@H]1CC[C@H]2[C@@H]3[C@@H]4O[C@@H]4[C@@]4(O)CC=CC(=O)[C@]4(C)[C@H]3CC[C@@]21C |
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| 00010000 81000000 00000801 10010101 00290001 00000001 00020000 08001402 01000000 00508048 08000200 40409010 8402802a 02800000 02000405 01280008 00820004 00000000 10446010 00008a01 00000000 00000a00 0100a000 00000010 00201000 80200400 00405000 a0000000 00004240 00000000 0e00a000 00000010 | 00050040 81040000 00400800 80010300 40482080 00000001 02000280 00000402 01000000 00108008 40040200 40009000 14028028 22820000 00000404 0009900c 00820000 00000120 23492090 00002001 00000020 00000a80 05408000 08000012 00201400 00000500 00404000 80000028 00002240 01000000 24020000 00000012 |