On Target NS3_HCV1A 0.33910036/CHEMBL3645728
For the given ligand Cobicistat, we have found in our database that, being scored 0.33910036, the most similar ligand is CHEMBL3645728. Check out the elaboration below.
| Cobicistat (Given Ligand) | CHEMBL3645728 (Similar Ligand) |
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| CC(C)c5nc(CN(C)C(=O)N[C@@H](CCN1CCOCC1)C(=O)N[C@H](CC[C@H](Cc2ccccc2)NC(=O)OCc3cncs3)Cc4ccccc4)cs5 | C=C[C@@H]1C[C@]1(NC(=O)[C@@H]1C[C@@]2(CN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)c1[nH]c(C)c(C)c1C(C)=O)C(C)(C)C)C(C)(C)C)C(C)(C)C21CCC1)C(=O)NS(=O)(=O)C1CC1 |
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| 0103000a 01403400 1010090a b4010e10 000000c2 00108002 00002084 2001f00f 10600b80 004a09e0 08318a00 f003b000 0400b052 00212001 000a3008 001e012c 1002c010 020804a0 00012850 8100ca41 80002900 782d1ed0 32100009 9351001c 02051400 8c008802 00200001 90221005 0c081206 04061013 a0124000 a0892601 | 0001808a 0d80b800 00100100 55300e10 04000020 00108012 100a2080 2200340d 10400100 00598898 00292404 40013000 8600c89a 0934a011 80420480 080c810c 02004000 02000026 40312400 00004201 84020000 bc0786f0 20806003 3254003c 02142000 40000000 08004010 9000100c 08000104 80060083 a4024200 01016270 |