Compile Data Set for Download or QSAR
Found 3 Enz. Inhib. hit(s) for PDB: 2IWU
TargetATP-dependent molecular chaperone HSP82(Saccharomyces cerevisiae)
University of Nottingham

LigandPNGBDBM68261(Microlactone, 15f trans)
Show SMILES Oc1cc(O)c2c(CC(=O)CCC\C=C\CCOC2=O)c1Cl
Show InChI InChI=1S/C16H17ClO5/c17-15-11-8-10(18)6-4-2-1-3-5-7-22-16(21)14(11)12(19)9-13(15)20/h1,3,9,19-20H,2,4-8H2/b3-1+
Affinity DataIC50: 590nMAssay Description:Binding competition assay with a fluorescent probe.More data for this Ligand-Target Pair
TargetATP-dependent molecular chaperone HSP82(Saccharomyces cerevisiae)
University of Nottingham

LigandPNGBDBM68261(Microlactone, 15f trans)
Show SMILES Oc1cc(O)c2c(CC(=O)CCC\C=C\CCOC2=O)c1Cl
Show InChI InChI=1S/C16H17ClO5/c17-15-11-8-10(18)6-4-2-1-3-5-7-22-16(21)14(11)12(19)9-13(15)20/h1,3,9,19-20H,2,4-8H2/b3-1+
Affinity DataIC50: 1.00E+3nMAssay Description:Binding competition assay with a fluorescent probe.More data for this Ligand-Target Pair
TargetATP-dependent molecular chaperone HSP82(Saccharomyces cerevisiae)
University of Nottingham

LigandPNGBDBM68261(Microlactone, 15f trans)
Show SMILES Oc1cc(O)c2c(CC(=O)CCC\C=C\CCOC2=O)c1Cl
Show InChI InChI=1S/C16H17ClO5/c17-15-11-8-10(18)6-4-2-1-3-5-7-22-16(21)14(11)12(19)9-13(15)20/h1,3,9,19-20H,2,4-8H2/b3-1+
Affinity DataIC50: 3.50E+3nMAssay Description:A colorimetric assay for the release of inorganic phosphate upon hydrolysis of ATP was used to determine the potency of Hsp 90 inhibitor against enzy...More data for this Ligand-Target Pair