On Target BACE1_HUMAN 0.25777778/CHEMBL3361312
For the given ligand riluzole, we have found in our database that, being scored 0.25777778, the most similar ligand is CHEMBL3361312. Check out the elaboration below.
| riluzole (Given Ligand) | CHEMBL3361312 (Similar Ligand) |
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| Nc2nc1C/C=C(OC(F)(F)F)\Cc1s2 | CC[C@@H](Cc1csc(C)n1)C(=O)N[C@@H](CNC(=O)OC(C)(C)C)C(=O)N[C@@H](CC(C)C)[C@@H](O)C[C@@H](C)C(=O)N[C@@H](C(C)C)C(=O)NCC(C)C |
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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 | 00070002 01407400 00100802 15000600 08180080 00018000 010000a0 28018008 00800a00 000801a0 00208a00 5001b000 0e00801a 00003001 801a2000 001e000c 10028000 06080081 00402818 00004601 20000000 308c0eb0 23000001 72110018 02005000 0c000402 00200000 102011a4 08000204 04061019 a0024080 20012a00 |