On Target PA_INFA 0.30316743/CHEMBL2040578
For the given ligand Dasabuvir, we have found in our database that, being scored 0.30316743, the most similar ligand is CHEMBL2040578. Check out the elaboration below.
| Dasabuvir (Given Ligand) | CHEMBL2040578 (Similar Ligand) |
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| COc4c(c2ccc1cc(NS(C)(=O)=O)ccc1c2)cc(n3ccc(=O)[nH]c3=O)cc4C(C)(C)C | CC(NC(=O)c1nc(-c2cnccn2)[nH]c(=O)c1O)c1ccccc1 |
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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 | 00000202 00811808 40000100 10050e10 00000068 00124006 00c09800 0a003405 16000100 40180860 08290004 40048810 00008802 00708003 00820400 000c200c 08002068 1200b022 80c00000 10400000 80000000 48008600 21800040 4050011c 00044806 c0000680 28000030 80041004 0000410c 07660c03 c4048000 500006a0 |