On Target NA_A-H3N8 0.2840909/CHEMBL4278505
For the given ligand Aspirin, we have found in our database that, being scored 0.2840909, the most similar ligand is CHEMBL4278505. Check out the elaboration below.
| Aspirin (Given Ligand) | CHEMBL4278505 (Similar Ligand) |
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| NC3CCC(CO)/C(=C/1CCCc2ccccc12)C3 | CCC(CC)O[C@@H]1C=C(C(=O)O)C[C@H](NCc2ccc(Cc3ccccc3)cc2)[C@H]1NC(C)=O |
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| 00080000 01000000 00000b02 00010600 22080000 00002000 80080080 00000403 00000800 001808c0 08100200 41018000 00020000 01a00000 00000406 0008000a 00000600 02000040 02412000 00000001 00100100 58000010 0100c020 00400010 01200000 80002001 00406000 c0000000 00400002 00060802 24020000 00000400 | 00070040 09007000 00100100 84010700 00180080 00000800 02080180 3b00140a 11000100 001908c8 48200000 41019801 8402881a 01882000 00001408 00081008 10a04000 02000060 60c12010 00000201 00000020 38048e80 13008080 02500018 10001401 e0001400 00c04000 d0000001 0c000380 00060403 24060000 00800e10 |