On Target PGH1_HUMAN 0.24324325/CHEMBL2112567
For the given ligand Genipin, we have found in our database that, being scored 0.24324325, the most similar ligand is CHEMBL2112567. Check out the elaboration below.
| Genipin (Given Ligand) | CHEMBL2112567 (Similar Ligand) |
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| COC(=O)/C1=C/O[C@@H](O)[C@@H]2/C(CO)=C\C[C@H]12 | CC(C)(C)c1cc(/C=C2\CCOC2=O)cc2c1OCC2(C)C |
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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 | 04041000 00000008 20000308 00010200 00001041 82000000 82040080 00000640 01800000 00180840 48000200 40009000 04808002 00000000 010c0007 00082018 08020400 22008000 24418018 00028001 00000000 48000a00 0100a001 00400010 01001400 c0000000 00422008 40800404 00404300 00220002 04000000 00000410 |