On Target NS3_HCV1B 0.30451128/CHEMBL1170408
For the given ligand Dasabuvir, we have found in our database that, being scored 0.30451128, the most similar ligand is CHEMBL1170408. Check out the elaboration below.
| Dasabuvir (Given Ligand) | CHEMBL1170408 (Similar Ligand) |
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| COc4c(c2ccc1cc(NS(C)(=O)=O)ccc1c2)cc(n3ccc(=O)[nH]c3=O)cc4C(C)(C)C | C=CCCCS(=O)(=O)NC(=O)[C@H](CCC)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)OC(C)(C)C)C(C)(C)C)c1ccc(Oc2cc(-c3ccccc3)nc3cc(OC)ccc23)c(C=C)c1 |
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| 00002022 00000208 2000010a 02310600 00081041 04004000 02008002 00003208 06400100 800808e0 0c00200c 40008000 00009c02 00400001 812c00c1 000e200c 08020008 02009000 04400400 00024000 40020080 18008808 31800041 81704010 02040080 c0080080 38048200 0004004d 04404300 1046000a 40040200 010106e0 | 08012082 65c03008 20184108 15310600 00241021 00018000 96060080 22081408 20800284 105988c0 08202404 4011b000 0f00c802 00442001 c1420441 025ea00c 02020040 02082004 04282810 00465a01 c0400000 bc248e19 30800103 b3440038 02000000 c0000002 08322048 9020406c 0c404384 00260403 a4067c00 01252670 |