On Target NS3_HCV1B 0.14932127/CHEMBL1170408
For the given ligand 2 Coumarinate, we have found in our database that, being scored 0.14932127, the most similar ligand is CHEMBL1170408. Check out the elaboration below.
| 2 Coumarinate (Given Ligand) | CHEMBL1170408 (Similar Ligand) |
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| O=C(O)/C=C\c1ccccc1O | 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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| 00000000 00000008 20000100 00010200 00200000 00000000 82000080 00000400 01800000 00000840 00000000 40008000 04008002 00000000 00000002 00082008 00000400 02000000 10018018 00020000 00000000 08000a00 00000000 00400000 00001000 80000000 00402000 40000000 00400000 00020000 04000000 00000002 | 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 |