On Target NOS3_HUMAN 0.1779661/CHEMBL1956111
For the given ligand Genipin, we have found in our database that, being scored 0.1779661, the most similar ligand is CHEMBL1956111. Check out the elaboration below.
| Genipin (Given Ligand) | CHEMBL1956111 (Similar Ligand) |
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| COC(=O)/C1=C/O[C@@H](O)[C@@H]2/C(CO)=C\C[C@H]12 | CNC(=N)NCCC[C@H](N)C(=O)OC |
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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 | 00010000 01000000 00100000 00010d00 00080000 00000000 00000004 00002000 00200200 00000082 00200000 4003b000 04009010 01000000 00001000 00180008 00820000 00000000 00400000 00000001 00000100 10010a00 03000000 00100010 00010000 00000000 40000000 10000000 00000210 00040000 80080000 00000200 |