On Target PERM_HUMAN 0.2173913/CHEMBL3145355
For the given ligand GABAPENTIN, we have found in our database that, being scored 0.2173913, the most similar ligand is CHEMBL3145355. Check out the elaboration below.
| GABAPENTIN (Given Ligand) | CHEMBL3145355 (Similar Ligand) |
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| NCC1(CC(=O)O)CCCCC1 | CC(C)N1Nc2ccccc2C1=O |
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| 00030000 01000000 00000000 00000400 00180000 00000000 00000000 00000000 00000000 00000080 00000000 40011000 04008008 00800000 00000000 00080008 00000000 00000000 02402000 00000001 00000000 10000a10 01000000 00000010 00000000 00000000 00000000 00000000 00000000 00040000 00020000 00000000 | 00000004 00000408 20000000 00000600 000c0000 00000020 02000000 00000000 06000000 400008c0 00000008 40018000 00009002 00e00000 00000000 000d000c 00000000 00008000 00600000 00220000 00000000 1c010018 01800801 02300010 00100000 00000000 00000000 00080000 00000000 00060000 00000000 00004020 |