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PubMed code 24471873

Compile data set for download or QSAR
Found 4 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50011471
PNG
(CHEMBL3261276)
Show SMILES COc1cc(OC)c(\C=C\S(=O)(=O)Cc2ccc(OC)c(N)n2)c(OC)c1
Show InChI InChI=1S/C18H22N2O6S/c1-23-13-9-16(25-3)14(17(10-13)26-4)7-8-27(21,22)11-12-5-6-15(24-2)18(19)20-12/h5-10H,11H2,1-4H3,(H2,19,20)/b8-7+
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Article
PubMed
n/an/a>2.50E+4n/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in CHO cells


J Med Chem 57: 2275-91 (2014)


Article DOI: 10.1021/jm4019614
BindingDB Entry DOI: 10.7270/Q2H70HBC
More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50011472
PNG
(CHEMBL3261266)
Show SMILES COc1cc(OC)c(\C=C\S(=O)(=O)Cc2cnc(OC)c(NS(C)(=O)=O)c2)c(OC)c1
Show InChI InChI=1S/C19H24N2O8S2/c1-26-14-9-17(27-2)15(18(10-14)28-3)6-7-31(24,25)12-13-8-16(21-30(5,22)23)19(29-4)20-11-13/h6-11,21H,12H2,1-5H3/b7-6+
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Article
PubMed
n/an/a>2.50E+4n/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in CHO cells


J Med Chem 57: 2275-91 (2014)


Article DOI: 10.1021/jm4019614
BindingDB Entry DOI: 10.7270/Q2H70HBC
More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50011470
PNG
(CHEMBL3261265)
Show SMILES COc1cc(OC)c(\C=C\S(=O)(=O)Cc2cnc(OC)c(N)c2)c(OC)c1
Show InChI InChI=1S/C18H22N2O6S/c1-23-13-8-16(24-2)14(17(9-13)25-3)5-6-27(21,22)11-12-7-15(19)18(26-4)20-10-12/h5-10H,11,19H2,1-4H3/b6-5+
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Article
PubMed
n/an/a>2.50E+4n/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in CHO cells


J Med Chem 57: 2275-91 (2014)


Article DOI: 10.1021/jm4019614
BindingDB Entry DOI: 10.7270/Q2H70HBC
More data for this
Ligand-Target Pair
Voltage-gated potassium channel


(Homo sapiens (human))
BDBM50011473
PNG
(CHEMBL3261277)
Show SMILES COc1cc(OC)c(\C=C\S(=O)(=O)Cc2ccc(OC)c(NS(C)(=O)=O)n2)c(OC)c1
Show InChI InChI=1S/C19H24N2O8S2/c1-26-14-10-17(28-3)15(18(11-14)29-4)8-9-31(24,25)12-13-6-7-16(27-2)19(20-13)21-30(5,22)23/h6-11H,12H2,1-5H3,(H,20,21)/b9-8+
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Article
PubMed
n/an/a>2.50E+4n/an/an/an/an/an/a



University of South Australia

Curated by ChEMBL


Assay Description
Inhibition of human ERG expressed in CHO cells


J Med Chem 57: 2275-91 (2014)


Article DOI: 10.1021/jm4019614
BindingDB Entry DOI: 10.7270/Q2H70HBC
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%