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PubMed code 20580552

Compile data set for download or QSAR
Found 8 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
Mitogen-activated protein kinase kinase kinase 14


(Homo sapiens (Human))
BDBM50059889
PNG
((staurosporine)3-methoxy-2-methyl-4-methylamino-(2...)
Show SMILES CN[C@@H]1CC2O[C@@](C)([C@@H]1OC)n1c3ccccc3c3c4CNC(=O)c4c4c5ccccc5n2c4c13
Show InChI InChI=1S/C28H26N4O3/c1-28-26(34-3)17(29-2)12-20(35-28)31-18-10-6-4-8-14(18)22-23-16(13-30-27(23)33)21-15-9-5-7-11-19(15)32(28)25(21)24(22)31/h4-11,17,20,26,29H,12-13H2,1-3H3,(H,30,33)/t17-,20?,26-,28+/m1/s1
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PubMed
n/an/a 2.30E+3n/an/an/an/an/an/a



University of Namur

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused NIK expressed in Sf9 cells after 60 mins by radiometric protein kinase assay


Bioorg Med Chem Lett 20: 4515-20 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.027
BindingDB Entry DOI: 10.7270/Q2D79BKX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 14


(Homo sapiens (Human))
BDBM50322999
PNG
(4-(ethoxymethylene)isoquinoline-1,3(2H,4H)-dione |...)
Show SMILES CCO\C=C1\C(=O)NC(=O)c2ccccc12
Show InChI InChI=1S/C12H11NO3/c1-2-16-7-10-8-5-3-4-6-9(8)11(14)13-12(10)15/h3-7H,2H2,1H3,(H,13,14,15)/b10-7+
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n/an/a>5.00E+4n/an/an/an/an/an/a



University of Namur

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused NIK expressed in Sf9 cells after 60 mins by radiometric protein kinase assay


Bioorg Med Chem Lett 20: 4515-20 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.027
BindingDB Entry DOI: 10.7270/Q2D79BKX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 14


(Homo sapiens (Human))
BDBM50322995
PNG
(CHEMBL1210769 | cid_349435 | isoquinoline-1,3(2H,4...)
Show SMILES O=C1Cc2ccccc2C(=O)N1
Show InChI InChI=1S/C9H7NO2/c11-8-5-6-3-1-2-4-7(6)9(12)10-8/h1-4H,5H2,(H,10,11,12)
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PubMed
n/an/a 5.10E+4n/an/an/an/an/an/a



University of Namur

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused NIK expressed in Sf9 cells after 60 mins by radiometric protein kinase assay


Bioorg Med Chem Lett 20: 4515-20 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.027
BindingDB Entry DOI: 10.7270/Q2D79BKX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 14


(Homo sapiens (Human))
BDBM50322996
PNG
(2,7-naphthyridine-1,3,6,8-tetrone | CHEMBL1210770)
Show SMILES O=C1CC2CC(=O)NC(=O)C2C(=O)N1
Show InChI InChI=1S/C8H8N2O4/c11-4-1-3-2-5(12)10-8(14)6(3)7(13)9-4/h3,6H,1-2H2,(H,9,11,13)(H,10,12,14)
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n/an/a 9.00E+4n/an/an/an/an/an/a



University of Namur

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused NIK expressed in Sf9 cells after 60 mins by radiometric protein kinase assay


Bioorg Med Chem Lett 20: 4515-20 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.027
BindingDB Entry DOI: 10.7270/Q2D79BKX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 14


(Homo sapiens (Human))
BDBM50322998
PNG
(4-(thiophen-2-ylmethylene)isoquinoline-1,3(2H,4H)-...)
Show SMILES O=C1NC(=O)c2ccccc2\C1=C/c1cccs1
Show InChI InChI=1S/C14H9NO2S/c16-13-11-6-2-1-5-10(11)12(14(17)15-13)8-9-4-3-7-18-9/h1-8H,(H,15,16,17)/b12-8+
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n/an/a>1.00E+5n/an/an/an/an/an/a



University of Namur

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused NIK expressed in Sf9 cells after 60 mins by radiometric protein kinase assay


Bioorg Med Chem Lett 20: 4515-20 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.027
BindingDB Entry DOI: 10.7270/Q2D79BKX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 14


(Homo sapiens (Human))
BDBM50323000
PNG
(5,7-dichloroquinazoline-2,4(1H,3H)-dione | CHEMBL1...)
Show SMILES Clc1cc(Cl)c2c(c1)[nH]c(=O)[nH]c2=O
Show InChI InChI=1S/C8H4Cl2N2O2/c9-3-1-4(10)6-5(2-3)11-8(14)12-7(6)13/h1-2H,(H2,11,12,13,14)
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PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Namur

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused NIK expressed in Sf9 cells after 60 mins by radiometric protein kinase assay


Bioorg Med Chem Lett 20: 4515-20 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.027
BindingDB Entry DOI: 10.7270/Q2D79BKX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 14


(Homo sapiens (Human))
BDBM50012070
PNG
(5-Hydroxy-2-methyl-[1,4]naphthoquinone | 5-hydroxy...)
Show SMILES CC1=CC(=O)c2c(O)cccc2C1=O |t:1|
Show InChI InChI=1S/C11H8O3/c1-6-5-9(13)10-7(11(6)14)3-2-4-8(10)12/h2-5,12H,1H3
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PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Namur

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused NIK expressed in Sf9 cells after 60 mins by radiometric protein kinase assay


Bioorg Med Chem Lett 20: 4515-20 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.027
BindingDB Entry DOI: 10.7270/Q2D79BKX
More data for this
Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase 14


(Homo sapiens (Human))
BDBM50322997
PNG
(1,2-dihydroisoquinolin-3(4H)-one | CHEMBL1210771)
Show SMILES O=C1Cc2ccccc2CN1
Show InChI InChI=1S/C9H9NO/c11-9-5-7-3-1-2-4-8(7)6-10-9/h1-4H,5-6H2,(H,10,11)
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



University of Namur

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused NIK expressed in Sf9 cells after 60 mins by radiometric protein kinase assay


Bioorg Med Chem Lett 20: 4515-20 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.027
BindingDB Entry DOI: 10.7270/Q2D79BKX
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%