On Target NA_A-H3N8 0.1635514/CHEMBL4292576
For the given ligand Erlotinib, we have found in our database that, being scored 0.1635514, the most similar ligand is CHEMBL4292576. Check out the elaboration below.
| Erlotinib (Given Ligand) | CHEMBL4292576 (Similar Ligand) |
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| C#Cc3cccc(Nc1ncnc2cc(OCCOC)c(OCCOC)cc12)c3 | CCC(CC)O[C@@H]1C=C(C(=O)O)C[C@H](NCc2ccc(OC)cc2)[C@H]1NC(C)=O |
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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 | 00070040 09007008 20100108 84010700 00181080 00000800 020c0180 3a00140a 11000000 001108c8 40200000 41019001 0402881a 01882000 01001409 00081008 10a04000 02000060 60c12010 00020201 00000020 38048e80 13008080 02500018 10001401 c0001400 00e24000 90000001 0c000300 00060401 24060000 00800a10 |