On Target BTK_HUMAN 0.24193548/CHEMBL5872185
For the given ligand Genipin, we have found in our database that, being scored 0.24193548, the most similar ligand is CHEMBL5872185. Check out the elaboration below.
| Genipin (Given Ligand) | CHEMBL5872185 (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#CC(=O)N1CCC2(CC(C3(NC(=O)c4cn[nH]c4)C=C(N)C(OC(C)C)=CC3)C2)C1 |
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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 | 00400210 4d049008 20120080 80000611 40402011 00100811 02184000 28101430 00000000 001000c8 48240000 40418200 80028002 00010010 02103400 000c030c 20020000 02000142 60406090 00220a01 00002000 10040e30 42898800 0014011a 00001440 80008c00 00484200 90040300 00005200 000e0401 ac020020 c0000230 |