On Target MDR1_HUMAN 0.39130434/CHEMBL1276308
For the given ligand Nai, we have found in our database that, being scored 0.39130434, the most similar ligand is CHEMBL1276308. Check out the elaboration below.
| Nai (Given Ligand) | CHEMBL1276308 (Similar Ligand) |
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| C=C1/C=C\C=C/CC(=C)C1c2ccccc2 | CC#C[C@]1(O)CC[C@H]2[C@@H]3CCC4=CC(=O)CCC4=C3[C@H](C[C@]12C)c5ccc(cc5)N(C)C |
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| 00000400 01040000 00000102 00110200 40010000 00800001 00000001 00000400 00000800 00180842 08100000 40408000 00020000 00200000 00000400 00000004 00000000 02100000 00002080 00000001 00002101 08000000 00008000 00400812 00000000 80002000 00404200 80000000 00000000 00020002 24800000 00010400 | 00010202 01040800 00000102 40010200 40482000 00800001 00200081 00000402 01000800 00988848 08300084 40009008 04028008 20a08000 00000442 0009000c 00040000 02100020 0a692080 02000801 40000108 08000280 21008800 00400012 00200000 80000000 00404200 80000080 00008002 81060202 24020804 00000400 |