On Target NS3_HCV1A 0.541502/CHEMBL3645617
For the given ligand Paritaprevir, we have found in our database that, being scored 0.541502, the most similar ligand is CHEMBL3645617. Check out the elaboration below.
| Paritaprevir (Given Ligand) | CHEMBL3645617 (Similar Ligand) |
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| Cc8cnc(C(=O)N[C@H]7CCCCC/C=C\[C@@H]1C[C@@]1(C(=O)NS(=O)(=O)C2CC2)NC(=O)[C@@H]6C[C@@H](Oc4nc3ccccc3c5ccccc45)CN6C7=O)cn8 | C=C[C@@H]1C[C@]1(NC(=O)[C@@H]1C[C@@]2(CN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)c1cnccn1)C1CCOCC1)C(C)(C)C)C(C)(C)C21CCC1)C(=O)NS(=O)(=O)N1CCCC1 |
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| 1405a082 0d807018 20104908 15310f12 841410c0 02118110 060ac000 2000340b 10010200 005188d8 012d2404 4101b000 0682c81a 09542003 b1da15c1 001ca10c 1a224000 02000142 40e12000 02024201 c0020040 bc178e38 33a0c083 b2140138 02340001 00000000 08c04200 9000000d 0c000204 80060c81 a4064000 85012a70 | 100180a2 09803000 06100800 15210d10 80180040 00100010 000ac000 20003409 10000000 0011c188 01692000 4001b000 0601803a 01102011 a0c20400 000c110c 0c824000 02000002 44412000 00004201 80000020 30078e30 21004003 32900038 00140400 00000000 08000200 90000014 08000204 c0060881 e4024004 80012a60 |