On Target BTK_HUMAN 0.23943663/CHEMBL5872185
For the given ligand Geniposide, we have found in our database that, being scored 0.23943663, the most similar ligand is CHEMBL5872185. Check out the elaboration below.
| Geniposide (Given Ligand) | CHEMBL5872185 (Similar Ligand) |
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| COC(=O)/C2=C/O[C@@H](O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@@H]3/C(CO)=C\C[C@H]23 | 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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| 00010040 81000000 00000801 90010101 80290041 00000001 00022880 08001402 01200000 015080e8 08000200 40419010 8402802a 02800000 02000405 012a9008 00820004 00000000 1145e010 00008a01 00100020 00001a90 0500a000 08100010 00201420 80200400 00405002 a4000020 00004240 00000000 0ea0a000 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 |