On Target PAR1_HUMAN 0.2631579/CHEMBL4111522
For the given ligand riluzole, we have found in our database that, being scored 0.2631579, the most similar ligand is CHEMBL4111522. Check out the elaboration below.
| riluzole (Given Ligand) | CHEMBL4111522 (Similar Ligand) |
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| Nc2nc1C/C=C(OC(F)(F)F)\Cc1s2 | C[C@H]1OC(=O)[C@@]2(CC(F)(F)C(C)[C@H](\C=C\c3ccc(cn3)c4ccccc4C#N)C12)C(O)c5cscn5 |
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| 0003040a 00000000 0c100e80 00010096 09000040 00800010 20402180 0002a44b 81420000 00dc3140 01808a00 5000a000 8000c008 00200041 02422001 000c800c 10000c00 02020080 00100050 80204000 00000800 00880080 2100c800 54010010 02045000 8c000400 00600080 c0000004 1203420c 04162800 24800000 200302c0 | 00072042 81000009 00104b02 91010710 082c1460 04000008 81000081 08008408 00100b00 01988858 00008a05 50119000 14028808 00a01001 210a2402 828c100c 00c28400 0e000084 17e02018 10816403 41100020 08908a80 318084e0 70510010 01041401 8e0814a0 08606260 d00082c4 0040c206 0e060482 24020020 20010e00 |