On Target E2AK2_HUMAN 0.1563981/CHEMBL416056
For the given ligand Genipin, we have found in our database that, being scored 0.1563981, the most similar ligand is CHEMBL416056. Check out the elaboration below.
| Genipin (Given Ligand) | CHEMBL416056 (Similar Ligand) |
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| COC(=O)/C1=C/O[C@@H](O)[C@@H]2/C(CO)=C\C[C@H]12 | COC(=O)[C@]1(O)C[C@@H]2O[C@@]1(C)n1c3ccccc3c3c4c(c5c6ccccc6n2c5c31)C(=O)NC4 |
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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 | 00060002 01c09800 00000100 90010700 003e00e0 00308000 00008c00 82001004 00000000 018008d0 00200004 4003d002 9c008802 00e80100 000c14c0 001cd00c 08a22028 02800184 19e01000 00000001 c0080020 18068e98 27800000 8c50001c 10004400 c0200002 00008340 90000070 00400301 00060041 803d8200 00000220 |