On Target NS3_HCV1A 0.35622317/CHEMBL3960420
For the given ligand Erlotinib, we have found in our database that, being scored 0.35622317, the most similar ligand is CHEMBL3960420. Check out the elaboration below.
| Erlotinib (Given Ligand) | CHEMBL3960420 (Similar Ligand) |
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| C#Cc3cccc(Nc1ncnc2cc(OCCOC)c(OCCOC)cc12)c3 | COc1ccc(Sc2ccc(C#Cc3ccc(NC(=O)[C@@H]4CCCN4C(=O)OCc4ccccc4)cc3)cc2Nc2ncnc3nc(C(C)C)ccc23)cc1 |
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| 04000002 00004008 20000908 08290600 00443000 00004000 06088010 00000808 00002100 00000850 01300004 40009800 04804027 00400000 01200041 020c800c 00040000 12004008 0860000a 10260400 41000000 08040028 24804040 0a400000 00042004 80000000 02040000 00800080 00408208 00460008 40000000 002001c0 | 1101420a 01c27a08 201a4928 1c190600 24443020 0001e010 02009010 00000808 10802300 00080ad0 08399004 6081b800 0e008813 0091a000 81020441 1a1e000e 04061000 72084400 08600c9a 12220201 c1100000 38848e70 20806041 8258001f 00044004 80002202 02a080d0 102000a0 0a40820c 01460003 e000c000 200106e0 |