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PubMed code 22061645

Compile data set for download or QSAR
Found 68 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
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359154
PNG
(CHEMBL1922974)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3c(F)ccc(Cl)c3F)cccc12
Show InChI InChI=1S/C23H16ClF2N5O2S/c1-11-22(34-30-27-11)21-13(23(32)29-28-21)8-12-9-31(2)17-4-3-5-18(19(12)17)33-10-14-16(25)7-6-15(24)20(14)26/h3-9,28H,1,10H2,2H3,(H,29,32)/b13-8?,22-21-
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n/an/a 5n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359164
PNG
(CHEMBL1922984)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3c(F)cccc3F)cccc12
Show InChI InChI=1S/C23H16F2N4O2S/c1-29-11-13(10-14-21(27-28-22(14)30)23-26-8-9-32-23)20-18(29)6-3-7-19(20)31-12-15-16(24)4-2-5-17(15)25/h2-11H,12H2,1H3,(H,28,30)/b14-10-
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n/an/a 9n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359149
PNG
(CHEMBL1922969)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccc(F)cc3)cccc12
Show InChI InChI=1S/C23H18FN5O2S/c1-13-22(32-28-25-13)21-17(23(30)27-26-21)10-15-11-29(2)18-4-3-5-19(20(15)18)31-12-14-6-8-16(24)9-7-14/h3-11,26H,1,12H2,2H3,(H,27,30)/b17-10?,22-21-
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n/an/a 12n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359151
PNG
(CHEMBL1922971)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccc(F)cc3F)cccc12
Show InChI InChI=1S/C23H17F2N5O2S/c1-12-22(33-29-26-12)21-16(23(31)28-27-21)8-14-10-30(2)18-4-3-5-19(20(14)18)32-11-13-6-7-15(24)9-17(13)25/h3-10,27H,1,11H2,2H3,(H,28,31)/b16-8?,22-21-
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n/an/a 12n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359150
PNG
(CHEMBL1922970)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3c(F)cccc3F)cccc12
Show InChI InChI=1S/C23H17F2N5O2S/c1-12-22(33-29-26-12)21-14(23(31)28-27-21)9-13-10-30(2)18-7-4-8-19(20(13)18)32-11-15-16(24)5-3-6-17(15)25/h3-10,27H,1,11H2,2H3,(H,28,31)/b14-9?,22-21-
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n/an/a 12n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359147
PNG
(CHEMBL1922967)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccccc3F)cccc12
Show InChI InChI=1S/C23H18FN5O2S/c1-13-22(32-28-25-13)21-16(23(30)27-26-21)10-15-11-29(2)18-8-5-9-19(20(15)18)31-12-14-6-3-4-7-17(14)24/h3-11,26H,1,12H2,2H3,(H,27,30)/b16-10?,22-21-
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n/an/a 13n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359165
PNG
(CHEMBL1922985)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3c(F)cccc3Cl)cccc12
Show InChI InChI=1S/C23H16ClFN4O2S/c1-29-11-13(10-14-21(27-28-22(14)30)23-26-8-9-32-23)20-18(29)6-3-7-19(20)31-12-15-16(24)4-2-5-17(15)25/h2-11H,12H2,1H3,(H,28,30)/b14-10-
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n/an/a 13n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359166
PNG
(CHEMBL1922986)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3cccc(F)c3F)cccc12
Show InChI InChI=1S/C23H16F2N4O2S/c1-29-11-14(10-15-21(27-28-22(15)30)23-26-8-9-32-23)19-17(29)6-3-7-18(19)31-12-13-4-2-5-16(24)20(13)25/h2-11H,12H2,1H3,(H,28,30)/b15-10-
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n/an/a 14n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359153
PNG
(CHEMBL1922973)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3c(F)ccc(F)c3Cl)cccc12
Show InChI InChI=1S/C23H16ClF2N5O2S/c1-11-22(34-30-27-11)21-13(23(32)29-28-21)8-12-9-31(2)17-4-3-5-18(19(12)17)33-10-14-15(25)6-7-16(26)20(14)24/h3-9,28H,1,10H2,2H3,(H,29,32)/b13-8?,22-21-
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n/an/a 14n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359167
PNG
(CHEMBL1922987)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3cc(F)ccc3F)cccc12
Show InChI InChI=1S/C23H16F2N4O2S/c1-29-11-13(10-16-21(27-28-22(16)30)23-26-7-8-32-23)20-18(29)3-2-4-19(20)31-12-14-9-15(24)5-6-17(14)25/h2-11H,12H2,1H3,(H,28,30)/b16-10-
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n/an/a 17n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359148
PNG
(CHEMBL1922968)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3cccc(F)c3)cccc12
Show InChI InChI=1S/C23H18FN5O2S/c1-13-22(32-28-25-13)21-17(23(30)27-26-21)10-15-11-29(2)18-7-4-8-19(20(15)18)31-12-14-5-3-6-16(24)9-14/h3-11,26H,1,12H2,2H3,(H,27,30)/b17-10?,22-21-
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n/an/a 20n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359152
PNG
(CHEMBL1922972)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3c(F)cccc3Cl)cccc12
Show InChI InChI=1S/C23H17ClFN5O2S/c1-12-22(33-29-26-12)21-14(23(31)28-27-21)9-13-10-30(2)18-7-4-8-19(20(13)18)32-11-15-16(24)5-3-6-17(15)25/h3-10,27H,1,11H2,2H3,(H,28,31)/b14-9?,22-21-
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n/an/a 21n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359141
PNG
(CHEMBL1922961)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccccc3)cccc12
Show InChI InChI=1S/C23H19N5O2S/c1-14-22(31-27-24-14)21-17(23(29)26-25-21)11-16-12-28(2)18-9-6-10-19(20(16)18)30-13-15-7-4-3-5-8-15/h3-12,25H,1,13H2,2H3,(H,26,29)/b17-11?,22-21-
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n/an/a 23n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359161
PNG
(CHEMBL1922981)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3cccc(F)c3)cccc12
Show InChI InChI=1S/C23H17FN4O2S/c1-28-12-15(11-17-21(26-27-22(17)29)23-25-8-9-31-23)20-18(28)6-3-7-19(20)30-13-14-4-2-5-16(24)10-14/h2-12H,13H2,1H3,(H,27,29)/b17-11-
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n/an/a 25n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359143
PNG
(CHEMBL1922963)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3cccnc3)cccc12
Show InChI InChI=1S/C22H18N6O2S/c1-13-21(31-27-24-13)20-16(22(29)26-25-20)9-15-11-28(2)17-6-3-7-18(19(15)17)30-12-14-5-4-8-23-10-14/h3-11,25H,1,12H2,2H3,(H,26,29)/b16-9?,21-20-
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n/an/a 34n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50203074
PNG
(4-((4-ethoxy-1-methyl-1H-indol-3-yl)methylene)-3-(...)
Show SMILES CCOc1cccc2n(C)cc(C=c3c(=O)[nH][nH]\c3=c3/snnc3=C)c12
Show InChI InChI=1S/C18H17N5O2S/c1-4-25-14-7-5-6-13-15(14)11(9-23(13)3)8-12-16(20-21-18(12)24)17-10(2)19-22-26-17/h5-9,20H,2,4H2,1,3H3,(H,21,24)/b12-8?,17-16-
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n/an/a 36n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human cytoplasmic domain of VEGFR-2 by time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359163
PNG
(CHEMBL1922983)
Show SMILES CC(Oc1cccc2n(C)cc(\C=C3/C(=O)NN=C3c3nccs3)c12)c1ccccc1
Show InChI InChI=1S/C24H20N4O2S/c1-15(16-7-4-3-5-8-16)30-20-10-6-9-19-21(20)17(14-28(19)2)13-18-22(26-27-23(18)29)24-25-11-12-31-24/h3-15H,1-2H3,(H,27,29)/b18-13-
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n/an/a 42n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359160
PNG
(CHEMBL1922980)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3ccccc3F)cccc12
Show InChI InChI=1S/C23H17FN4O2S/c1-28-12-15(11-16-21(26-27-22(16)29)23-25-9-10-31-23)20-18(28)7-4-8-19(20)30-13-14-5-2-3-6-17(14)24/h2-12H,13H2,1H3,(H,27,29)/b16-11-
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n/an/a 46n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359156
PNG
(CHEMBL1922976)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3ccccc3)cccc12
Show InChI InChI=1S/C23H18N4O2S/c1-27-13-16(12-17-21(25-26-22(17)28)23-24-10-11-30-23)20-18(27)8-5-9-19(20)29-14-15-6-3-2-4-7-15/h2-13H,14H2,1H3,(H,26,28)/b17-12-
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n/an/a 46n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50203074
PNG
(4-((4-ethoxy-1-methyl-1H-indol-3-yl)methylene)-3-(...)
Show SMILES CCOc1cccc2n(C)cc(C=c3c(=O)[nH][nH]\c3=c3/snnc3=C)c12
Show InChI InChI=1S/C18H17N5O2S/c1-4-25-14-7-5-6-13-15(14)11(9-23(13)3)8-12-16(20-21-18(12)24)17-10(2)19-22-26-17/h5-9,20H,2,4H2,1,3H3,(H,21,24)/b12-8?,17-16-
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n/an/a 47n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359155
PNG
(CHEMBL1922975)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2cccnc2)c2c(OCc3ccccc3)cccc12
Show InChI InChI=1S/C25H20N4O2/c1-29-15-19(13-20-24(27-28-25(20)30)18-9-6-12-26-14-18)23-21(29)10-5-11-22(23)31-16-17-7-3-2-4-8-17/h2-15H,16H2,1H3,(H,28,30)/b20-13-
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n/an/a 54n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359144
PNG
(CHEMBL1922964)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccncc3)cccc12
Show InChI InChI=1S/C22H18N6O2S/c1-13-21(31-27-24-13)20-16(22(29)26-25-20)10-15-11-28(2)17-4-3-5-18(19(15)17)30-12-14-6-8-23-9-7-14/h3-11,25H,1,12H2,2H3,(H,26,29)/b16-10?,21-20-
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n/an/a 55n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359162
PNG
(CHEMBL1922982)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3ccc(F)cc3)cccc12
Show InChI InChI=1S/C23H17FN4O2S/c1-28-12-15(11-17-21(26-27-22(17)29)23-25-9-10-31-23)20-18(28)3-2-4-19(20)30-13-14-5-7-16(24)8-6-14/h2-12H,13H2,1H3,(H,27,29)/b17-11-
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n/an/a 63n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359166
PNG
(CHEMBL1922986)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3cccc(F)c3F)cccc12
Show InChI InChI=1S/C23H16F2N4O2S/c1-29-11-14(10-15-21(27-28-22(15)30)23-26-8-9-32-23)19-17(29)6-3-7-18(19)31-12-13-4-2-5-16(24)20(13)25/h2-11H,12H2,1H3,(H,28,30)/b15-10-
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n/an/a 90n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359164
PNG
(CHEMBL1922984)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3c(F)cccc3F)cccc12
Show InChI InChI=1S/C23H16F2N4O2S/c1-29-11-13(10-14-21(27-28-22(14)30)23-26-8-9-32-23)20-18(29)6-3-7-19(20)31-12-15-16(24)4-2-5-17(15)25/h2-11H,12H2,1H3,(H,28,30)/b14-10-
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n/an/a 100n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359159
PNG
(CHEMBL1922979)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2cccs2)c2c(OCc3ccccc3)cccc12
Show InChI InChI=1S/C24H19N3O2S/c1-27-14-17(13-18-23(25-26-24(18)28)21-11-6-12-30-21)22-19(27)9-5-10-20(22)29-15-16-7-3-2-4-8-16/h2-14H,15H2,1H3,(H,26,28)/b18-13-
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n/an/a 104n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359161
PNG
(CHEMBL1922981)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3cccc(F)c3)cccc12
Show InChI InChI=1S/C23H17FN4O2S/c1-28-12-15(11-17-21(26-27-22(17)29)23-25-8-9-31-23)20-18(28)6-3-7-19(20)30-13-14-4-2-5-16(24)10-14/h2-12H,13H2,1H3,(H,27,29)/b17-11-
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n/an/a 120n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359142
PNG
(CHEMBL1922962)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccccn3)cccc12
Show InChI InChI=1S/C22H18N6O2S/c1-13-21(31-27-24-13)20-16(22(29)26-25-20)10-14-11-28(2)17-7-5-8-18(19(14)17)30-12-15-6-3-4-9-23-15/h3-11,25H,1,12H2,2H3,(H,26,29)/b16-10?,21-20-
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n/an/a 158n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359152
PNG
(CHEMBL1922972)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3c(F)cccc3Cl)cccc12
Show InChI InChI=1S/C23H17ClFN5O2S/c1-12-22(33-29-26-12)21-14(23(31)28-27-21)9-13-10-30(2)18-7-4-8-19(20(13)18)32-11-15-16(24)5-3-6-17(15)25/h3-10,27H,1,11H2,2H3,(H,28,31)/b14-9?,22-21-
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n/an/a 200n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359151
PNG
(CHEMBL1922971)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccc(F)cc3F)cccc12
Show InChI InChI=1S/C23H17F2N5O2S/c1-12-22(33-29-26-12)21-16(23(31)28-27-21)8-14-10-30(2)18-4-3-5-19(20(14)18)32-11-13-6-7-15(24)9-17(13)25/h3-10,27H,1,11H2,2H3,(H,28,31)/b16-8?,22-21-
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n/an/a 200n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359167
PNG
(CHEMBL1922987)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3cc(F)ccc3F)cccc12
Show InChI InChI=1S/C23H16F2N4O2S/c1-29-11-13(10-16-21(27-28-22(16)30)23-26-7-8-32-23)20-18(29)3-2-4-19(20)31-12-14-9-15(24)5-6-17(14)25/h2-11H,12H2,1H3,(H,28,30)/b16-10-
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n/an/a 200n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359165
PNG
(CHEMBL1922985)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3c(F)cccc3Cl)cccc12
Show InChI InChI=1S/C23H16ClFN4O2S/c1-29-11-13(10-14-21(27-28-22(14)30)23-26-8-9-32-23)20-18(29)6-3-7-19(20)31-12-15-16(24)4-2-5-17(15)25/h2-11H,12H2,1H3,(H,28,30)/b14-10-
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n/an/a 200n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359168
PNG
(CHEMBL1922988)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3ccc(F)cc3F)cccc12
Show InChI InChI=1S/C23H16F2N4O2S/c1-29-11-14(9-16-21(27-28-22(16)30)23-26-7-8-32-23)20-18(29)3-2-4-19(20)31-12-13-5-6-15(24)10-17(13)25/h2-11H,12H2,1H3,(H,28,30)/b16-9-
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n/an/a 229n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359146
PNG
(CHEMBL1922966)
Show SMILES CN(C)CCOc1cccc2n(C)cc(C=c3c(=O)[nH][nH]\c3=c3/snnc3=C)c12
Show InChI InChI=1S/C20H22N6O2S/c1-12-19(29-24-21-12)18-14(20(27)23-22-18)10-13-11-26(4)15-6-5-7-16(17(13)15)28-9-8-25(2)3/h5-7,10-11,22H,1,8-9H2,2-4H3,(H,23,27)/b14-10?,19-18-
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n/an/a 291n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359150
PNG
(CHEMBL1922970)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3c(F)cccc3F)cccc12
Show InChI InChI=1S/C23H17F2N5O2S/c1-12-22(33-29-26-12)21-14(23(31)28-27-21)9-13-10-30(2)18-7-4-8-19(20(13)18)32-11-15-16(24)5-3-6-17(15)25/h3-10,27H,1,11H2,2H3,(H,28,31)/b14-9?,22-21-
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n/an/a 300n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50203074
PNG
(4-((4-ethoxy-1-methyl-1H-indol-3-yl)methylene)-3-(...)
Show SMILES CCOc1cccc2n(C)cc(C=c3c(=O)[nH][nH]\c3=c3/snnc3=C)c12
Show InChI InChI=1S/C18H17N5O2S/c1-4-25-14-7-5-6-13-15(14)11(9-23(13)3)8-12-16(20-21-18(12)24)17-10(2)19-22-26-17/h5-9,20H,2,4H2,1,3H3,(H,21,24)/b12-8?,17-16-
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n/an/a 300n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359153
PNG
(CHEMBL1922973)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3c(F)ccc(F)c3Cl)cccc12
Show InChI InChI=1S/C23H16ClF2N5O2S/c1-11-22(34-30-27-11)21-13(23(32)29-28-21)8-12-9-31(2)17-4-3-5-18(19(12)17)33-10-14-15(25)6-7-16(26)20(14)24/h3-9,28H,1,10H2,2H3,(H,29,32)/b13-8?,22-21-
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n/an/a 300n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359156
PNG
(CHEMBL1922976)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3ccccc3)cccc12
Show InChI InChI=1S/C23H18N4O2S/c1-27-13-16(12-17-21(25-26-22(17)28)23-24-10-11-30-23)20-18(27)8-5-9-19(20)29-14-15-6-3-2-4-7-15/h2-13H,14H2,1H3,(H,26,28)/b17-12-
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n/an/a 300n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50359141
PNG
(CHEMBL1922961)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccccc3)cccc12
Show InChI InChI=1S/C23H19N5O2S/c1-14-22(31-27-24-14)21-17(23(29)26-25-21)11-16-12-28(2)18-9-6-10-19(20(16)18)30-13-15-7-4-3-5-8-15/h3-12,25H,1,13H2,2H3,(H,26,29)/b17-11?,22-21-
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n/an/a>300n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of human cytoplasmic domain of VEGFR-2 by time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359160
PNG
(CHEMBL1922980)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3ccccc3F)cccc12
Show InChI InChI=1S/C23H17FN4O2S/c1-28-12-15(11-16-21(26-27-22(16)29)23-25-9-10-31-23)20-18(28)7-4-8-19(20)30-13-14-5-2-3-6-17(14)24/h2-12H,13H2,1H3,(H,27,29)/b16-11-
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n/an/a 400n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359154
PNG
(CHEMBL1922974)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3c(F)ccc(Cl)c3F)cccc12
Show InChI InChI=1S/C23H16ClF2N5O2S/c1-11-22(34-30-27-11)21-13(23(32)29-28-21)8-12-9-31(2)17-4-3-5-18(19(12)17)33-10-14-16(25)7-6-15(24)20(14)26/h3-9,28H,1,10H2,2H3,(H,29,32)/b13-8?,22-21-
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n/an/a 400n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359147
PNG
(CHEMBL1922967)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccccc3F)cccc12
Show InChI InChI=1S/C23H18FN5O2S/c1-13-22(32-28-25-13)21-16(23(30)27-26-21)10-15-11-29(2)18-8-5-9-19(20(15)18)31-12-14-6-3-4-7-17(14)24/h3-11,26H,1,12H2,2H3,(H,27,30)/b16-10?,22-21-
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n/an/a 400n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359149
PNG
(CHEMBL1922969)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccc(F)cc3)cccc12
Show InChI InChI=1S/C23H18FN5O2S/c1-13-22(32-28-25-13)21-17(23(30)27-26-21)10-15-11-29(2)18-4-3-5-19(20(15)18)31-12-14-6-8-16(24)9-7-14/h3-11,26H,1,12H2,2H3,(H,27,30)/b17-10?,22-21-
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n/an/a 400n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359164
PNG
(CHEMBL1922984)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3c(F)cccc3F)cccc12
Show InChI InChI=1S/C23H16F2N4O2S/c1-29-11-13(10-14-21(27-28-22(14)30)23-26-8-9-32-23)20-18(29)6-3-7-19(20)31-12-15-16(24)4-2-5-17(15)25/h2-11H,12H2,1H3,(H,28,30)/b14-10-
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n/an/a 428n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359163
PNG
(CHEMBL1922983)
Show SMILES CC(Oc1cccc2n(C)cc(\C=C3/C(=O)NN=C3c3nccs3)c12)c1ccccc1
Show InChI InChI=1S/C24H20N4O2S/c1-15(16-7-4-3-5-8-16)30-20-10-6-9-19-21(20)17(14-28(19)2)13-18-22(26-27-23(18)29)24-25-11-12-31-24/h3-15H,1-2H3,(H,27,29)/b18-13-
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n/an/a 500n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359141
PNG
(CHEMBL1922961)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccccc3)cccc12
Show InChI InChI=1S/C23H19N5O2S/c1-14-22(31-27-24-14)21-17(23(29)26-25-21)11-16-12-28(2)18-9-6-10-19(20(16)18)30-13-15-7-4-3-5-8-15/h3-12,25H,1,13H2,2H3,(H,26,29)/b17-11?,22-21-
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n/an/a 650n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359153
PNG
(CHEMBL1922973)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3c(F)ccc(F)c3Cl)cccc12
Show InChI InChI=1S/C23H16ClF2N5O2S/c1-11-22(34-30-27-11)21-13(23(32)29-28-21)8-12-9-31(2)17-4-3-5-18(19(12)17)33-10-14-15(25)6-7-16(26)20(14)24/h3-9,28H,1,10H2,2H3,(H,29,32)/b13-8?,22-21-
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n/an/a 661n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359152
PNG
(CHEMBL1922972)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3c(F)cccc3Cl)cccc12
Show InChI InChI=1S/C23H17ClFN5O2S/c1-12-22(33-29-26-12)21-14(23(31)28-27-21)9-13-10-30(2)18-7-4-8-19(20(13)18)32-11-15-16(24)5-3-6-17(15)25/h3-10,27H,1,11H2,2H3,(H,28,31)/b14-9?,22-21-
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n/an/a 720n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359154
PNG
(CHEMBL1922974)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3c(F)ccc(Cl)c3F)cccc12
Show InChI InChI=1S/C23H16ClF2N5O2S/c1-11-22(34-30-27-11)21-13(23(32)29-28-21)8-12-9-31(2)17-4-3-5-18(19(12)17)33-10-14-16(25)7-6-15(24)20(14)26/h3-9,28H,1,10H2,2H3,(H,29,32)/b13-8?,22-21-
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n/an/a 861n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50203074
PNG
(4-((4-ethoxy-1-methyl-1H-indol-3-yl)methylene)-3-(...)
Show SMILES CCOc1cccc2n(C)cc(C=c3c(=O)[nH][nH]\c3=c3/snnc3=C)c12
Show InChI InChI=1S/C18H17N5O2S/c1-4-25-14-7-5-6-13-15(14)11(9-23(13)3)8-12-16(20-21-18(12)24)17-10(2)19-22-26-17/h5-9,20H,2,4H2,1,3H3,(H,21,24)/b12-8?,17-16-
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n/an/a 998n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359161
PNG
(CHEMBL1922981)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3cccc(F)c3)cccc12
Show InChI InChI=1S/C23H17FN4O2S/c1-28-12-15(11-17-21(26-27-22(17)29)23-25-8-9-31-23)20-18(28)6-3-7-19(20)30-13-14-4-2-5-16(24)10-14/h2-12H,13H2,1H3,(H,27,29)/b17-11-
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n/an/a>1.00E+3n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359148
PNG
(CHEMBL1922968)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3cccc(F)c3)cccc12
Show InChI InChI=1S/C23H18FN5O2S/c1-13-22(32-28-25-13)21-17(23(30)27-26-21)10-15-11-29(2)18-7-4-8-19(20(15)18)31-12-14-5-3-6-16(24)9-14/h3-11,26H,1,12H2,2H3,(H,27,30)/b17-10?,22-21-
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n/an/a 1.00E+3n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359150
PNG
(CHEMBL1922970)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3c(F)cccc3F)cccc12
Show InChI InChI=1S/C23H17F2N5O2S/c1-12-22(33-29-26-12)21-14(23(31)28-27-21)9-13-10-30(2)18-7-4-8-19(20(13)18)32-11-15-16(24)5-3-6-17(15)25/h3-10,27H,1,11H2,2H3,(H,28,31)/b14-9?,22-21-
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n/an/a>1.00E+3n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359165
PNG
(CHEMBL1922985)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3c(F)cccc3Cl)cccc12
Show InChI InChI=1S/C23H16ClFN4O2S/c1-29-11-13(10-14-21(27-28-22(14)30)23-26-8-9-32-23)20-18(29)6-3-7-19(20)31-12-15-16(24)4-2-5-17(15)25/h2-11H,12H2,1H3,(H,28,30)/b14-10-
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n/an/a 1.42E+3n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359144
PNG
(CHEMBL1922964)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccncc3)cccc12
Show InChI InChI=1S/C22H18N6O2S/c1-13-21(31-27-24-13)20-16(22(29)26-25-20)10-15-11-28(2)17-4-3-5-18(19(15)17)30-12-14-6-8-23-9-7-14/h3-11,25H,1,12H2,2H3,(H,26,29)/b16-10?,21-20-
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n/an/a 1.60E+3n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359143
PNG
(CHEMBL1922963)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3cccnc3)cccc12
Show InChI InChI=1S/C22H18N6O2S/c1-13-21(31-27-24-13)20-16(22(29)26-25-20)9-15-11-28(2)17-6-3-7-18(19(15)17)30-12-14-5-4-8-23-10-14/h3-11,25H,1,12H2,2H3,(H,26,29)/b16-9?,21-20-
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n/an/a 2.50E+3n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of nucleophosmin-fused ALK autophosphorylation in human Karpas299 cells


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359145
PNG
(CHEMBL1922965)
Show SMILES Cc1nc(COc2cccc3n(C)cc(C=c4c(=O)[nH][nH]\c4=c4/snnc4=C)c23)cs1
Show InChI InChI=1S/C21H18N6O2S2/c1-11-20(31-26-23-11)19-15(21(28)25-24-19)7-13-8-27(3)16-5-4-6-17(18(13)16)29-9-14-10-30-12(2)22-14/h4-8,10,24H,1,9H2,2-3H3,(H,25,28)/b15-7?,20-19-
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n/an/a 3.00E+3n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359158
PNG
(CHEMBL1922978)
Show SMILES CN(C)c1nnc(s1)C1=NNC(=O)\C1=C/c1cn(C)c2cccc(OCc3ccccc3)c12
Show InChI InChI=1S/C24H22N6O2S/c1-29(2)24-28-27-23(33-24)21-17(22(31)26-25-21)12-16-13-30(3)18-10-7-11-19(20(16)18)32-14-15-8-5-4-6-9-15/h4-13H,14H2,1-3H3,(H,26,31)/b17-12-
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n/an/a 4.60E+3n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359166
PNG
(CHEMBL1922986)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3cccc(F)c3F)cccc12
Show InChI InChI=1S/C23H16F2N4O2S/c1-29-11-14(10-15-21(27-28-22(15)30)23-26-8-9-32-23)19-17(29)6-3-7-18(19)31-12-13-4-2-5-16(24)20(13)25/h2-11H,12H2,1H3,(H,28,30)/b15-10-
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n/an/a 6.50E+3n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359156
PNG
(CHEMBL1922976)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3ccccc3)cccc12
Show InChI InChI=1S/C23H18N4O2S/c1-27-13-16(12-17-21(25-26-22(17)28)23-24-10-11-30-23)20-18(27)8-5-9-19(20)29-14-15-6-3-2-4-7-15/h2-13H,14H2,1H3,(H,26,28)/b17-12-
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n/an/a 9.12E+3n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359141
PNG
(CHEMBL1922961)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccccc3)cccc12
Show InChI InChI=1S/C23H19N5O2S/c1-14-22(31-27-24-14)21-17(23(29)26-25-21)11-16-12-28(2)18-9-6-10-19(20(16)18)30-13-15-7-4-3-5-8-15/h3-12,25H,1,13H2,2H3,(H,26,29)/b17-11?,22-21-
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n/an/a>1.00E+4n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359147
PNG
(CHEMBL1922967)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccccc3F)cccc12
Show InChI InChI=1S/C23H18FN5O2S/c1-13-22(32-28-25-13)21-16(23(30)27-26-21)10-15-11-29(2)18-8-5-9-19(20(15)18)31-12-14-6-3-4-7-17(14)24/h3-11,26H,1,12H2,2H3,(H,27,30)/b16-10?,22-21-
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n/an/a>1.00E+4n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359160
PNG
(CHEMBL1922980)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nccs2)c2c(OCc3ccccc3F)cccc12
Show InChI InChI=1S/C23H17FN4O2S/c1-28-12-15(11-16-21(26-27-22(16)29)23-25-9-10-31-23)20-18(28)7-4-8-19(20)30-13-14-5-2-3-6-17(14)24/h2-12H,13H2,1H3,(H,27,29)/b16-11-
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n/an/a>1.00E+4n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359148
PNG
(CHEMBL1922968)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3cccc(F)c3)cccc12
Show InChI InChI=1S/C23H18FN5O2S/c1-13-22(32-28-25-13)21-17(23(30)27-26-21)10-15-11-29(2)18-7-4-8-19(20(15)18)31-12-14-5-3-6-16(24)9-14/h3-11,26H,1,12H2,2H3,(H,27,30)/b17-10?,22-21-
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n/an/a>1.00E+4n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359163
PNG
(CHEMBL1922983)
Show SMILES CC(Oc1cccc2n(C)cc(\C=C3/C(=O)NN=C3c3nccs3)c12)c1ccccc1
Show InChI InChI=1S/C24H20N4O2S/c1-15(16-7-4-3-5-8-16)30-20-10-6-9-19-21(20)17(14-28(19)2)13-18-22(26-27-23(18)29)24-25-11-12-31-24/h3-15H,1-2H3,(H,27,29)/b18-13-
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n/an/a>1.00E+4n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
ALK tyrosine kinase receptor


(Homo sapiens (Human))
BDBM50359157
PNG
(CHEMBL1922977)
Show SMILES Cn1cc(\C=C2/C(=O)NN=C2c2nc(cs2)C(F)(F)F)c2c(OCc3ccccc3)cccc12
Show InChI InChI=1S/C24H17F3N4O2S/c1-31-11-15(20-17(31)8-5-9-18(20)33-12-14-6-3-2-4-7-14)10-16-21(29-30-22(16)32)23-28-19(13-34-23)24(25,26)27/h2-11,13H,12H2,1H3,(H,30,32)/b16-10-
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n/an/a 1.00E+4n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of ALK


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359149
PNG
(CHEMBL1922969)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccc(F)cc3)cccc12
Show InChI InChI=1S/C23H18FN5O2S/c1-13-22(32-28-25-13)21-17(23(30)27-26-21)10-15-11-29(2)18-4-3-5-19(20(15)18)31-12-14-6-8-16(24)9-7-14/h3-11,26H,1,12H2,2H3,(H,27,30)/b17-10?,22-21-
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n/an/a>1.00E+4n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
Insulin receptor


(Homo sapiens (human))
BDBM50359151
PNG
(CHEMBL1922971)
Show SMILES Cn1cc(C=c2c(=O)[nH][nH]\c2=c2/snnc2=C)c2c(OCc3ccc(F)cc3F)cccc12
Show InChI InChI=1S/C23H17F2N5O2S/c1-12-22(33-29-26-12)21-16(23(31)28-27-21)8-14-10-30(2)18-4-3-5-19(20(14)18)32-11-13-6-7-15(24)9-17(13)25/h3-10,27H,1,11H2,2H3,(H,28,31)/b16-8?,22-21-
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n/an/a>1.00E+4n/an/an/an/an/an/a



Cephalon, Inc.

Curated by ChEMBL


Assay Description
Inhibition of GST-tagged intracellular domain of IR by homogeneous time-resolved fluorescence assay


Bioorg Med Chem Lett 21: 7261-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.10.055
BindingDB Entry DOI: 10.7270/Q2T43TH7
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%