Job #384 - Drug combination for dengue treatment

Created at: Last updated at: Current status:

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 Overall Progress
100.000%
 Ligand Models 1
Name Sunitinib
2D and 3D depictions 2D Depiction of Drug combination for dengue treatment 3D Depiction of Drug combination for dengue treatment
SMILES CCN(CC)CCNC(=O)c3c(C)[nH]c(C=c1c(=O)[nH]c2ccc(F)cc12)c3C
Model downloads
SMILES Protein Data Bank AutoDock PDBQT Sybyl Mol2 MDL MOL
Fingerprints
MACCS FP2 FP3 FP4 ECFP0 ECFP2 ECFP4 ECFP6 ECFP8 ECFP10
 Ligand Models 2
Name Erlotinib
2D and 3D depictions 2D Depiction of Drug combination for dengue treatment 3D Depiction of Drug combination for dengue treatment
SMILES C#Cc3cccc(Nc1ncnc2cc(OCCOC)c(OCCOC)cc12)c3
Model downloads
SMILES Protein Data Bank AutoDock PDBQT Sybyl Mol2 MDL MOL
Fingerprints
MACCS FP2 FP3 FP4 ECFP0 ECFP2 ECFP4 ECFP6 ECFP8 ECFP10