On Target AOFA_HUMAN 0.2542373/CHEMBL3605361
For the given ligand GABAPENTIN, we have found in our database that, being scored 0.2542373, the most similar ligand is CHEMBL3605361. Check out the elaboration below.
| GABAPENTIN (Given Ligand) | CHEMBL3605361 (Similar Ligand) |
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| NCC1(CC(=O)O)CCCCC1 | [I-].[I-].C[n+]1ccc2c(c1)c3ccccc3n2CCCCCCCCCn4c5ccccc5c6c[n+](C)ccc46 |
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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 | 00000002 01800000 00004000 00000600 000c0000 00000000 00000000 00000000 00000000 000008c0 00000004 40018000 00000800 00c00000 000000c0 00040004 00800000 00000000 00602000 00000001 40000000 18008018 20800040 80000010 00000000 80000000 00000000 00000000 00000000 00060000 00260200 00000400 |