On Target MSHR_HUMAN 0.34375/CHEMBL429212
For the given ligand C64, we have found in our database that, being scored 0.34375, the most similar ligand is CHEMBL429212. Check out the elaboration below.
| C64 (Given Ligand) | CHEMBL429212 (Similar Ligand) |
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| CCN(CC)c3ccc(CN(c1ccc(C)cc1)S(=O)(=O)c2ccc(OC)cc2)cc3 | COc1ccc(C[C@@H](NC(=O)[C@H]2Cc3ccccc3CN2)C(=O)N4CCC5(CC4)CN(c6ccccc56)S(=O)(=O)C)cc1 |
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| 00004012 00804808 2108010a 81b10600 00081000 00000000 06000001 02001000 00000000 00001840 00302004 6000c000 00040c02 00008001 81280041 00020008 00042000 02100000 08400800 00026000 c0100000 08008800 20050040 08400008 02000080 80000004 40800000 8000008c 00008700 20060000 00040000 00010360 | 0000c04a 23003208 2010090a 15310600 20001020 00002000 03050000 2200100c 00200880 004908c0 08302004 5003b000 06008c03 00202001 814a0541 02060008 00068000 02000020 08000008 00024201 40120100 38a48e00 20004003 93500019 02000880 c0000001 00124000 9000108c 0c008300 0086000b 20044080 20012670 |