On Target PGH2_HUMAN 0.17021276/CHEMBL512400
For the given ligand NAPQI, we have found in our database that, being scored 0.17021276, the most similar ligand is CHEMBL512400. Check out the elaboration below.
| NAPQI (Given Ligand) | CHEMBL512400 (Similar Ligand) |
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| CC(=O)N=c1ccc(=O)cc1 | C[C@@]12C[C@H]3OC(=O)C(=C)[C@H]3C[C@H]1C(=C)C(=O)C=C2 |
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| 00000000 00000000 00200000 00080400 00000000 00000000 10000000 12000402 01000020 00100003 00000000 40000001 00008000 00000000 00000000 00000080 00000800 00000000 00110000 00008040 00000001 20001680 00008000 00000810 00000000 00000000 40401000 00400800 00000010 00040000 06000000 00020000 | 00050040 81000000 00000100 80010300 00090000 00000000 02000080 00000402 01000000 00108008 00000000 40409000 04028008 00800000 00080404 00081008 00820000 00000020 02412010 0002a001 00000021 00000a80 01008000 00000810 00200400 00000000 00406200 80000000 00000200 00000002 24020000 00000010 |