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PubMed code 18362070

Compile data set for download or QSAR
Found 79 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
Tyrosine-protein kinase receptor FLT3


(Homo sapiens (Human))
BDBM50376343
PNG
(CHEMBL411903)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17F4N7O/c22-14-6-3-12(21(23,24)25)9-16(14)32-20(33)30-13-4-1-11(2-5-13)15-7-8-27-19-17(31-15)18(26)28-10-29-19/h1-6,9-10H,7-8H2,(H2,30,32,33)(H3,26,27,28,29)
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n/an/a 2n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Flt3


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor FLT3


(Homo sapiens (Human))
BDBM50376359
PNG
(CHEMBL260092)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H18F3N7O/c22-21(23,24)13-2-1-3-15(10-13)30-20(32)29-14-6-4-12(5-7-14)16-8-9-26-19-17(31-16)18(25)27-11-28-19/h1-7,10-11H,8-9H2,(H2,29,30,32)(H3,25,26,27,28)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Flt3


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor FLT3


(Homo sapiens (Human))
BDBM50376357
PNG
(CHEMBL410731)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cccc(c2F)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17F4N7O/c22-16-13(21(23,24)25)2-1-3-15(16)32-20(33)30-12-6-4-11(5-7-12)14-8-9-27-19-17(31-14)18(26)28-10-29-19/h1-7,10H,8-9H2,(H2,30,32,33)(H3,26,27,28,29)
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n/an/a 3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Flt3


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376359
PNG
(CHEMBL260092)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H18F3N7O/c22-21(23,24)13-2-1-3-15(10-13)30-20(32)29-14-6-4-12(5-7-14)16-8-9-26-19-17(31-16)18(25)27-11-28-19/h1-7,10-11H,8-9H2,(H2,29,30,32)(H3,25,26,27,28)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 1 mM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376343
PNG
(CHEMBL411903)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17F4N7O/c22-14-6-3-12(21(23,24)25)9-16(14)32-20(33)30-13-4-1-11(2-5-13)15-7-8-27-19-17(31-15)18(26)28-10-29-19/h1-6,9-10H,7-8H2,(H2,30,32,33)(H3,26,27,28,29)
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n/an/a 4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 1 mM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376356
PNG
(CHEMBL429516)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2ccc(F)c(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17F4N7O/c22-15-6-5-13(9-14(15)21(23,24)25)31-20(33)30-12-3-1-11(2-4-12)16-7-8-27-19-17(32-16)18(26)28-10-29-19/h1-6,9-10H,7-8H2,(H2,30,31,33)(H3,26,27,28,29)
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n/an/a 5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 1 mM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor FLT3


(Homo sapiens (Human))
BDBM50376363
PNG
(CHEMBL409872)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1
Show InChI InChI=1S/C20H18ClN7O/c21-13-2-1-3-15(10-13)27-20(29)26-14-6-4-12(5-7-14)16-8-9-23-19-17(28-16)18(22)24-11-25-19/h1-7,10-11H,8-9H2,(H2,26,27,29)(H3,22,23,24,25)
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n/an/a 6n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Flt3


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Kit (Kit)


(Homo sapiens (Human))
BDBM50376359
PNG
(CHEMBL260092)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H18F3N7O/c22-21(23,24)13-2-1-3-15(10-13)30-20(32)29-14-6-4-12(5-7-14)16-8-9-26-19-17(31-16)18(25)27-11-28-19/h1-7,10-11H,8-9H2,(H2,29,30,32)(H3,25,26,27,28)
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n/an/a 6n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of cKit


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376353
PNG
(CHEMBL403706)
Show SMILES Cc1ccc(cc1NC(=O)Nc1cccc(c1)C(F)(F)F)C1=Nc2c(N)ncnc2NCC1
Show InChI InChI=1S/C22H20F3N7O/c1-12-5-6-13(16-7-8-27-20-18(31-16)19(26)28-11-29-20)9-17(12)32-21(33)30-15-4-2-3-14(10-15)22(23,24)25/h2-6,9-11H,7-8H2,1H3,(H2,30,32,33)(H3,26,27,28,29)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 1 mM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376355
PNG
(CHEMBL412102)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17ClF3N7O/c22-15-6-5-13(9-14(15)21(23,24)25)31-20(33)30-12-3-1-11(2-4-12)16-7-8-27-19-17(32-16)18(26)28-10-29-19/h1-6,9-10H,7-8H2,(H2,30,31,33)(H3,26,27,28,29)
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n/an/a 6n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 1 mM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor FLT3


(Homo sapiens (Human))
BDBM50376356
PNG
(CHEMBL429516)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2ccc(F)c(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17F4N7O/c22-15-6-5-13(9-14(15)21(23,24)25)31-20(33)30-12-3-1-11(2-4-12)16-7-8-27-19-17(32-16)18(26)28-10-29-19/h1-6,9-10H,7-8H2,(H2,30,31,33)(H3,26,27,28,29)
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n/an/a 7n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Flt3


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor FLT3


(Homo sapiens (Human))
BDBM50376358
PNG
(CHEMBL259013)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H18F3N7O/c22-21(23,24)13-3-7-15(8-4-13)30-20(32)29-14-5-1-12(2-6-14)16-9-10-26-19-17(31-16)18(25)27-11-28-19/h1-8,11H,9-10H2,(H2,29,30,32)(H3,25,26,27,28)
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n/an/a 9n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Flt3


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Kit (Kit)


(Homo sapiens (Human))
BDBM50376343
PNG
(CHEMBL411903)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17F4N7O/c22-14-6-3-12(21(23,24)25)9-16(14)32-20(33)30-13-4-1-11(2-5-13)15-7-8-27-19-17(31-15)18(26)28-10-29-19/h1-6,9-10H,7-8H2,(H2,30,32,33)(H3,26,27,28,29)
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n/an/a 11n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of cKit


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Kit (Kit)


(Homo sapiens (Human))
BDBM50376353
PNG
(CHEMBL403706)
Show SMILES Cc1ccc(cc1NC(=O)Nc1cccc(c1)C(F)(F)F)C1=Nc2c(N)ncnc2NCC1
Show InChI InChI=1S/C22H20F3N7O/c1-12-5-6-13(16-7-8-27-20-18(31-16)19(26)28-11-29-20)9-17(12)32-21(33)30-15-4-2-3-14(10-15)22(23,24)25/h2-6,9-11H,7-8H2,1H3,(H2,30,32,33)(H3,26,27,28,29)
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n/an/a 12n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of cKit


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Mus musculus)
BDBM50376359
PNG
(CHEMBL260092)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cccc(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H18F3N7O/c22-21(23,24)13-2-1-3-15(10-13)30-20(32)29-14-6-4-12(5-7-14)16-8-9-26-19-17(31-16)18(25)27-11-28-19/h1-7,10-11H,8-9H2,(H2,29,30,32)(H3,25,26,27,28)
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n/an/a 13n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of VEGF-induced KDR phosphorylation in mouse 3T3 cells


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor FLT3


(Homo sapiens (Human))
BDBM50376362
PNG
(CHEMBL262607)
Show SMILES Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)C2=Nc3c(N)ncnc3NCC2)c1
Show InChI InChI=1S/C21H20FN7O/c1-12-2-7-15(22)17(10-12)29-21(30)27-14-5-3-13(4-6-14)16-8-9-24-20-18(28-16)19(23)25-11-26-20/h2-7,10-11H,8-9H2,1H3,(H2,27,29,30)(H3,23,24,25,26)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Flt3


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor FLT3


(Homo sapiens (Human))
BDBM50376355
PNG
(CHEMBL412102)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17ClF3N7O/c22-15-6-5-13(9-14(15)21(23,24)25)31-20(33)30-12-3-1-11(2-4-12)16-7-8-27-19-17(32-16)18(26)28-10-29-19/h1-6,9-10H,7-8H2,(H2,30,31,33)(H3,26,27,28,29)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Flt3


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Kit (Kit)


(Homo sapiens (Human))
BDBM50376363
PNG
(CHEMBL409872)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1
Show InChI InChI=1S/C20H18ClN7O/c21-13-2-1-3-15(10-13)27-20(29)26-14-6-4-12(5-7-14)16-8-9-23-19-17(28-16)18(22)24-11-25-19/h1-7,10-11H,8-9H2,(H2,26,27,29)(H3,22,23,24,25)
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n/an/a 18n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of cKit


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376363
PNG
(CHEMBL409872)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1
Show InChI InChI=1S/C20H18ClN7O/c21-13-2-1-3-15(10-13)27-20(29)26-14-6-4-12(5-7-14)16-8-9-23-19-17(28-16)18(22)24-11-25-19/h1-7,10-11H,8-9H2,(H2,26,27,29)(H3,22,23,24,25)
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Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 1 mM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Kit (Kit)


(Homo sapiens (Human))
BDBM50376356
PNG
(CHEMBL429516)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2ccc(F)c(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17F4N7O/c22-15-6-5-13(9-14(15)21(23,24)25)31-20(33)30-12-3-1-11(2-4-12)16-7-8-27-19-17(32-16)18(26)28-10-29-19/h1-6,9-10H,7-8H2,(H2,30,31,33)(H3,26,27,28,29)
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n/an/a 22n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of cKit


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Kit (Kit)


(Homo sapiens (Human))
BDBM50376357
PNG
(CHEMBL410731)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cccc(c2F)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17F4N7O/c22-16-13(21(23,24)25)2-1-3-15(16)32-20(33)30-12-6-4-11(5-7-12)14-8-9-27-19-17(31-14)18(26)28-10-29-19/h1-7,10H,8-9H2,(H2,30,32,33)(H3,26,27,28,29)
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n/an/a 28n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of cKit


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Kit (Kit)


(Homo sapiens (Human))
BDBM50376358
PNG
(CHEMBL259013)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H18F3N7O/c22-21(23,24)13-3-7-15(8-4-13)30-20(32)29-14-5-1-12(2-6-14)16-9-10-26-19-17(31-16)18(25)27-11-28-19/h1-8,11H,9-10H2,(H2,29,30,32)(H3,25,26,27,28)
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n/an/a 35n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of cKit


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Kit (Kit)


(Homo sapiens (Human))
BDBM50376362
PNG
(CHEMBL262607)
Show SMILES Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)C2=Nc3c(N)ncnc3NCC2)c1
Show InChI InChI=1S/C21H20FN7O/c1-12-2-7-15(22)17(10-12)29-21(30)27-14-5-3-13(4-6-14)16-8-9-24-20-18(28-16)19(23)25-11-26-20/h2-7,10-11H,8-9H2,1H3,(H2,27,29,30)(H3,23,24,25,26)
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n/an/a 37n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of cKit


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Mus musculus)
BDBM50376355
PNG
(CHEMBL412102)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17ClF3N7O/c22-15-6-5-13(9-14(15)21(23,24)25)31-20(33)30-12-3-1-11(2-4-12)16-7-8-27-19-17(32-16)18(26)28-10-29-19/h1-6,9-10H,7-8H2,(H2,30,31,33)(H3,26,27,28,29)
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n/an/a 49n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of VEGF-induced KDR phosphorylation in mouse 3T3 cells


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376357
PNG
(CHEMBL410731)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cccc(c2F)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17F4N7O/c22-16-13(21(23,24)25)2-1-3-15(16)32-20(33)30-12-6-4-11(5-7-12)14-8-9-27-19-17(31-14)18(26)28-10-29-19/h1-7,10H,8-9H2,(H2,30,32,33)(H3,26,27,28,29)
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n/an/a 49n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 1 mM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Kit (Kit)


(Homo sapiens (Human))
BDBM50376355
PNG
(CHEMBL412102)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2ccc(Cl)c(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17ClF3N7O/c22-15-6-5-13(9-14(15)21(23,24)25)31-20(33)30-12-3-1-11(2-4-12)16-7-8-27-19-17(32-16)18(26)28-10-29-19/h1-6,9-10H,7-8H2,(H2,30,31,33)(H3,26,27,28,29)
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n/an/a 50n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of cKit


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Mus musculus)
BDBM50376363
PNG
(CHEMBL409872)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cccc(Cl)c2)cc1
Show InChI InChI=1S/C20H18ClN7O/c21-13-2-1-3-15(10-13)27-20(29)26-14-6-4-12(5-7-14)16-8-9-23-19-17(28-16)18(22)24-11-25-19/h1-7,10-11H,8-9H2,(H2,26,27,29)(H3,22,23,24,25)
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n/an/a 50n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of VEGF-induced KDR phosphorylation in mouse 3T3 cells


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Mus musculus)
BDBM50376353
PNG
(CHEMBL403706)
Show SMILES Cc1ccc(cc1NC(=O)Nc1cccc(c1)C(F)(F)F)C1=Nc2c(N)ncnc2NCC1
Show InChI InChI=1S/C22H20F3N7O/c1-12-5-6-13(16-7-8-27-20-18(31-16)19(26)28-11-29-20)9-17(12)32-21(33)30-15-4-2-3-14(10-15)22(23,24)25/h2-6,9-11H,7-8H2,1H3,(H2,30,32,33)(H3,26,27,28,29)
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n/an/a 52n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of VEGF-induced KDR phosphorylation in mouse 3T3 cells


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376362
PNG
(CHEMBL262607)
Show SMILES Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)C2=Nc3c(N)ncnc3NCC2)c1
Show InChI InChI=1S/C21H20FN7O/c1-12-2-7-15(22)17(10-12)29-21(30)27-14-5-3-13(4-6-14)16-8-9-24-20-18(28-16)19(23)25-11-26-20/h2-7,10-11H,8-9H2,1H3,(H2,27,29,30)(H3,23,24,25,26)
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n/an/a 65n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 1 mM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Kit (Kit)


(Homo sapiens (Human))
BDBM50376361
PNG
(CHEMBL260848)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1cccc(NC(=O)Nc2cccc(c2)C(F)(F)F)c1
Show InChI InChI=1S/C21H18F3N7O/c22-21(23,24)13-4-2-6-15(10-13)30-20(32)29-14-5-1-3-12(9-14)16-7-8-26-19-17(31-16)18(25)27-11-28-19/h1-6,9-11H,7-8H2,(H2,29,30,32)(H3,25,26,27,28)
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n/an/a 91n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of cKit


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376358
PNG
(CHEMBL259013)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H18F3N7O/c22-21(23,24)13-3-7-15(8-4-13)30-20(32)29-14-5-1-12(2-6-14)16-9-10-26-19-17(31-16)18(25)27-11-28-19/h1-8,11H,9-10H2,(H2,29,30,32)(H3,25,26,27,28)
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n/an/a 110n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 1 mM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Mus musculus)
BDBM50376343
PNG
(CHEMBL411903)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cc(ccc2F)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17F4N7O/c22-14-6-3-12(21(23,24)25)9-16(14)32-20(33)30-13-4-1-11(2-5-13)15-7-8-27-19-17(31-15)18(26)28-10-29-19/h1-6,9-10H,7-8H2,(H2,30,32,33)(H3,26,27,28,29)
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n/an/a 121n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of VEGF-induced KDR phosphorylation in mouse 3T3 cells


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376361
PNG
(CHEMBL260848)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1cccc(NC(=O)Nc2cccc(c2)C(F)(F)F)c1
Show InChI InChI=1S/C21H18F3N7O/c22-21(23,24)13-4-2-6-15(10-13)30-20(32)29-14-5-1-3-12(9-14)16-7-8-26-19-17(31-16)18(25)27-11-28-19/h1-6,9-11H,7-8H2,(H2,29,30,32)(H3,25,26,27,28)
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n/an/a 126n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 1 mM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor FLT3


(Homo sapiens (Human))
BDBM50376353
PNG
(CHEMBL403706)
Show SMILES Cc1ccc(cc1NC(=O)Nc1cccc(c1)C(F)(F)F)C1=Nc2c(N)ncnc2NCC1
Show InChI InChI=1S/C22H20F3N7O/c1-12-5-6-13(16-7-8-27-20-18(31-16)19(26)28-11-29-20)9-17(12)32-21(33)30-15-4-2-3-14(10-15)22(23,24)25/h2-6,9-11H,7-8H2,1H3,(H2,30,32,33)(H3,26,27,28,29)
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n/an/a 135n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Flt3


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor FLT3


(Homo sapiens (Human))
BDBM50376361
PNG
(CHEMBL260848)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1cccc(NC(=O)Nc2cccc(c2)C(F)(F)F)c1
Show InChI InChI=1S/C21H18F3N7O/c22-21(23,24)13-4-2-6-15(10-13)30-20(32)29-14-5-1-3-12(9-14)16-7-8-26-19-17(31-16)18(25)27-11-28-19/h1-6,9-11H,7-8H2,(H2,29,30,32)(H3,25,26,27,28)
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n/an/a 145n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Flt3


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Mus musculus)
BDBM50376362
PNG
(CHEMBL262607)
Show SMILES Cc1ccc(F)c(NC(=O)Nc2ccc(cc2)C2=Nc3c(N)ncnc3NCC2)c1
Show InChI InChI=1S/C21H20FN7O/c1-12-2-7-15(22)17(10-12)29-21(30)27-14-5-3-13(4-6-14)16-8-9-24-20-18(28-16)19(23)25-11-26-20/h2-7,10-11H,8-9H2,1H3,(H2,27,29,30)(H3,23,24,25,26)
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n/an/a 311n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of VEGF-induced KDR phosphorylation in mouse 3T3 cells


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Mus musculus)
BDBM50376356
PNG
(CHEMBL429516)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2ccc(F)c(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17F4N7O/c22-15-6-5-13(9-14(15)21(23,24)25)31-20(33)30-12-3-1-11(2-4-12)16-7-8-27-19-17(32-16)18(26)28-10-29-19/h1-6,9-10H,7-8H2,(H2,30,31,33)(H3,26,27,28,29)
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n/an/a 345n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of VEGF-induced KDR phosphorylation in mouse 3T3 cells


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376348
PNG
(CHEMBL407532)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1cccc(Cl)c1
Show InChI InChI=1S/C13H12ClN5/c14-9-3-1-2-8(6-9)10-4-5-16-13-11(19-10)12(15)17-7-18-13/h1-3,6-7H,4-5H2,(H3,15,16,17,18)
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n/an/a 600n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 10 uM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Mus musculus)
BDBM50376361
PNG
(CHEMBL260848)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1cccc(NC(=O)Nc2cccc(c2)C(F)(F)F)c1
Show InChI InChI=1S/C21H18F3N7O/c22-21(23,24)13-4-2-6-15(10-13)30-20(32)29-14-5-1-3-12(9-14)16-7-8-26-19-17(31-16)18(25)27-11-28-19/h1-6,9-11H,7-8H2,(H2,29,30,32)(H3,25,26,27,28)
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n/an/a 790n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of VEGF-induced KDR phosphorylation in mouse 3T3 cells


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376354
PNG
(CHEMBL263374)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1cccc(NC(=O)Nc2ccccc2)c1
Show InChI InChI=1S/C20H19N7O/c21-18-17-19(24-12-23-18)22-10-9-16(27-17)13-5-4-8-15(11-13)26-20(28)25-14-6-2-1-3-7-14/h1-8,11-12H,9-10H2,(H2,25,26,28)(H3,21,22,23,24)
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n/an/a 888n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 1 mM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376352
PNG
(CHEMBL260093)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2ccccc2)cc1
Show InChI InChI=1S/C20H19N7O/c21-18-17-19(24-12-23-18)22-11-10-16(27-17)13-6-8-15(9-7-13)26-20(28)25-14-4-2-1-3-5-14/h1-9,12H,10-11H2,(H2,25,26,28)(H3,21,22,23,24)
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n/an/a 951n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 1 mM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Mus musculus)
BDBM50376357
PNG
(CHEMBL410731)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2cccc(c2F)C(F)(F)F)cc1
Show InChI InChI=1S/C21H17F4N7O/c22-16-13(21(23,24)25)2-1-3-15(16)32-20(33)30-12-6-4-11(5-7-12)14-8-9-27-19-17(31-14)18(26)28-10-29-19/h1-7,10H,8-9H2,(H2,30,32,33)(H3,26,27,28,29)
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n/an/a 1.52E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of VEGF-induced KDR phosphorylation in mouse 3T3 cells


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Mus musculus)
BDBM50376358
PNG
(CHEMBL259013)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(NC(=O)Nc2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C21H18F3N7O/c22-21(23,24)13-3-7-15(8-4-13)30-20(32)29-14-5-1-12(2-6-14)16-9-10-26-19-17(31-16)18(25)27-11-28-19/h1-8,11H,9-10H2,(H2,29,30,32)(H3,25,26,27,28)
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n/an/a 2.44E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of VEGF-induced KDR phosphorylation in mouse 3T3 cells


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor FLT3


(Homo sapiens (Human))
BDBM50376354
PNG
(CHEMBL263374)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1cccc(NC(=O)Nc2ccccc2)c1
Show InChI InChI=1S/C20H19N7O/c21-18-17-19(24-12-23-18)22-10-9-16(27-17)13-5-4-8-15(11-13)26-20(28)25-14-6-2-1-3-7-14/h1-8,11-12H,9-10H2,(H2,25,26,28)(H3,21,22,23,24)
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n/an/a 2.70E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Flt3


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase receptor FLT3


(Homo sapiens (Human))
BDBM50376360
PNG
(CHEMBL409839)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1ccc(NC(=O)Nc2ccccc2)cc1
Show InChI InChI=1S/C20H20N8O/c21-17-16-18(28-19(22)27-17)23-11-10-15(26-16)12-6-8-14(9-7-12)25-20(29)24-13-4-2-1-3-5-13/h1-9H,10-11H2,(H2,24,25,29)(H5,21,22,23,27,28)
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n/an/a 2.86E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Flt3


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376344
PNG
(CHEMBL262623)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccccc1
Show InChI InChI=1S/C13H13N5/c14-12-11-13(17-8-16-12)15-7-6-10(18-11)9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H3,14,15,16,17)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 10 uM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376347
PNG
(CHEMBL407265)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H12ClN5/c14-9-3-1-8(2-4-9)10-5-6-16-13-11(19-10)12(15)17-7-18-13/h1-4,7H,5-6H2,(H3,15,16,17,18)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 10 uM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376350
PNG
(CHEMBL263902)
Show SMILES Cc1cccc(c1)C1=Nc2c(N)ncnc2NCC1
Show InChI InChI=1S/C14H15N5/c1-9-3-2-4-10(7-9)11-5-6-16-14-12(19-11)13(15)17-8-18-14/h2-4,7-8H,5-6H2,1H3,(H3,15,16,17,18)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 10 uM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Kit (Kit)


(Homo sapiens (Human))
BDBM50376354
PNG
(CHEMBL263374)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1cccc(NC(=O)Nc2ccccc2)c1
Show InChI InChI=1S/C20H19N7O/c21-18-17-19(24-12-23-18)22-10-9-16(27-17)13-5-4-8-15(11-13)26-20(28)25-14-6-2-1-3-7-14/h1-8,11-12H,9-10H2,(H2,25,26,28)(H3,21,22,23,24)
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n/an/a 3.02E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of cKit


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376349
PNG
(CHEMBL405233)
Show SMILES Cc1ccc(cc1)C1=Nc2c(N)ncnc2NCC1
Show InChI InChI=1S/C14H15N5/c1-9-2-4-10(5-3-9)11-6-7-16-14-12(19-11)13(15)17-8-18-14/h2-5,8H,6-7H2,1H3,(H3,15,16,17,18)
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n/an/a 4.00E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 10 uM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376345
PNG
(CHEMBL260620)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H13ClN6/c14-8-3-1-7(2-4-8)9-5-6-17-12-10(18-9)11(15)19-13(16)20-12/h1-4H,5-6H2,(H5,15,16,17,19,20)
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n/an/a 9.00E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 10 uM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Tyrosine-protein kinase Kit (Kit)


(Homo sapiens (Human))
BDBM50376360
PNG
(CHEMBL409839)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1ccc(NC(=O)Nc2ccccc2)cc1
Show InChI InChI=1S/C20H20N8O/c21-17-16-18(28-19(22)27-17)23-11-10-15(26-16)12-6-8-14(9-7-12)25-20(29)24-13-4-2-1-3-5-13/h1-9H,10-11H2,(H2,24,25,29)(H5,21,22,23,27,28)
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n/an/a>1.30E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of cKit


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376360
PNG
(CHEMBL409839)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1ccc(NC(=O)Nc2ccccc2)cc1
Show InChI InChI=1S/C20H20N8O/c21-17-16-18(28-19(22)27-17)23-11-10-15(26-16)12-6-8-14(9-7-12)25-20(29)24-13-4-2-1-3-5-13/h1-9H,10-11H2,(H2,24,25,29)(H5,21,22,23,27,28)
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n/an/a>1.30E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 1 mM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376346
PNG
(CHEMBL259381)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1cccc(Cl)c1
Show InChI InChI=1S/C13H13ClN6/c14-8-3-1-2-7(6-8)9-4-5-17-12-10(18-9)11(15)19-13(16)20-12/h1-3,6H,4-5H2,(H5,15,16,17,19,20)
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n/an/a 2.10E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 10 uM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (human))
BDBM50376351
PNG
(CHEMBL259380)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1ccccc1
Show InChI InChI=1S/C13H14N6/c14-11-10-12(19-13(15)18-11)16-7-6-9(17-10)8-4-2-1-3-5-8/h1-5H,6-7H2,(H5,14,15,16,18,19)
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n/an/a 3.50E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KDR in presence of 10 uM ATP


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (human))
BDBM50376350
PNG
(CHEMBL263902)
Show SMILES Cc1cccc(c1)C1=Nc2c(N)ncnc2NCC1
Show InChI InChI=1S/C14H15N5/c1-9-3-2-4-10(7-9)11-5-6-16-14-12(19-11)13(15)17-8-18-14/h2-4,7-8H,5-6H2,1H3,(H3,15,16,17,18)
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n/an/a 5.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Plk1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50376344
PNG
(CHEMBL262623)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccccc1
Show InChI InChI=1S/C13H13N5/c14-12-11-13(17-8-16-12)15-7-6-10(18-11)9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H3,14,15,16,17)
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n/an/a 9.20E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50376351
PNG
(CHEMBL259380)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1ccccc1
Show InChI InChI=1S/C13H14N6/c14-11-10-12(19-13(15)18-11)16-7-6-9(17-10)8-4-2-1-3-5-8/h1-5H,6-7H2,(H5,14,15,16,18,19)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50376345
PNG
(CHEMBL260620)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H13ClN6/c14-8-3-1-7(2-4-8)9-5-6-17-12-10(18-9)11(15)19-13(16)20-12/h1-4H,5-6H2,(H5,15,16,17,19,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50376345
PNG
(CHEMBL260620)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H13ClN6/c14-8-3-1-7(2-4-8)9-5-6-17-12-10(18-9)11(15)19-13(16)20-12/h1-4H,5-6H2,(H5,15,16,17,19,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (human))
BDBM50376349
PNG
(CHEMBL405233)
Show SMILES Cc1ccc(cc1)C1=Nc2c(N)ncnc2NCC1
Show InChI InChI=1S/C14H15N5/c1-9-2-4-10(5-3-9)11-6-7-16-14-12(19-11)13(15)17-8-18-14/h2-5,8H,6-7H2,1H3,(H3,15,16,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Plk1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50376349
PNG
(CHEMBL405233)
Show SMILES Cc1ccc(cc1)C1=Nc2c(N)ncnc2NCC1
Show InChI InChI=1S/C14H15N5/c1-9-2-4-10(5-3-9)11-6-7-16-14-12(19-11)13(15)17-8-18-14/h2-5,8H,6-7H2,1H3,(H3,15,16,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50376351
PNG
(CHEMBL259380)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1ccccc1
Show InChI InChI=1S/C13H14N6/c14-11-10-12(19-13(15)18-11)16-7-6-9(17-10)8-4-2-1-3-5-8/h1-5H,6-7H2,(H5,14,15,16,18,19)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (human))
BDBM50376346
PNG
(CHEMBL259381)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1cccc(Cl)c1
Show InChI InChI=1S/C13H13ClN6/c14-8-3-1-2-7(6-8)9-4-5-17-12-10(18-9)11(15)19-13(16)20-12/h1-3,6H,4-5H2,(H5,15,16,17,19,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Plk1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (human))
BDBM50376345
PNG
(CHEMBL260620)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H13ClN6/c14-8-3-1-7(2-4-8)9-5-6-17-12-10(18-9)11(15)19-13(16)20-12/h1-4H,5-6H2,(H5,15,16,17,19,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Plk1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50376349
PNG
(CHEMBL405233)
Show SMILES Cc1ccc(cc1)C1=Nc2c(N)ncnc2NCC1
Show InChI InChI=1S/C14H15N5/c1-9-2-4-10(5-3-9)11-6-7-16-14-12(19-11)13(15)17-8-18-14/h2-5,8H,6-7H2,1H3,(H3,15,16,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50376350
PNG
(CHEMBL263902)
Show SMILES Cc1cccc(c1)C1=Nc2c(N)ncnc2NCC1
Show InChI InChI=1S/C14H15N5/c1-9-3-2-4-10(7-9)11-5-6-16-14-12(19-11)13(15)17-8-18-14/h2-4,7-8H,5-6H2,1H3,(H3,15,16,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50376348
PNG
(CHEMBL407532)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1cccc(Cl)c1
Show InChI InChI=1S/C13H12ClN5/c14-9-3-1-2-8(6-9)10-4-5-16-13-11(19-10)12(15)17-7-18-13/h1-3,6-7H,4-5H2,(H3,15,16,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50376347
PNG
(CHEMBL407265)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H12ClN5/c14-9-3-1-8(2-4-9)10-5-6-16-13-11(19-10)12(15)17-7-18-13/h1-4,7H,5-6H2,(H3,15,16,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50376347
PNG
(CHEMBL407265)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H12ClN5/c14-9-3-1-8(2-4-9)10-5-6-16-13-11(19-10)12(15)17-7-18-13/h1-4,7H,5-6H2,(H3,15,16,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50376346
PNG
(CHEMBL259381)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1cccc(Cl)c1
Show InChI InChI=1S/C13H13ClN6/c14-8-3-1-2-7(6-8)9-4-5-17-12-10(18-9)11(15)19-13(16)20-12/h1-3,6H,4-5H2,(H5,15,16,17,19,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (human))
BDBM50376347
PNG
(CHEMBL407265)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccc(Cl)cc1
Show InChI InChI=1S/C13H12ClN5/c14-9-3-1-8(2-4-9)10-5-6-16-13-11(19-10)12(15)17-7-18-13/h1-4,7H,5-6H2,(H3,15,16,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Plk1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50376344
PNG
(CHEMBL262623)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccccc1
Show InChI InChI=1S/C13H13N5/c14-12-11-13(17-8-16-12)15-7-6-10(18-11)9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H3,14,15,16,17)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Pak4


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50376350
PNG
(CHEMBL263902)
Show SMILES Cc1cccc(c1)C1=Nc2c(N)ncnc2NCC1
Show InChI InChI=1S/C14H15N5/c1-9-3-2-4-10(7-9)11-5-6-16-14-12(19-11)13(15)17-8-18-14/h2-4,7-8H,5-6H2,1H3,(H3,15,16,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (human))
BDBM50376344
PNG
(CHEMBL262623)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1ccccc1
Show InChI InChI=1S/C13H13N5/c14-12-11-13(17-8-16-12)15-7-6-10(18-11)9-4-2-1-3-5-9/h1-5,8H,6-7H2,(H3,14,15,16,17)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Plk1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (human))
BDBM50376348
PNG
(CHEMBL407532)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1cccc(Cl)c1
Show InChI InChI=1S/C13H12ClN5/c14-9-3-1-2-8(6-9)10-4-5-16-13-11(19-10)12(15)17-7-18-13/h1-3,6-7H,4-5H2,(H3,15,16,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Plk1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase PLK1


(Homo sapiens (human))
BDBM50376351
PNG
(CHEMBL259380)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1ccccc1
Show InChI InChI=1S/C13H14N6/c14-11-10-12(19-13(15)18-11)16-7-6-9(17-10)8-4-2-1-3-5-8/h1-5H,6-7H2,(H5,14,15,16,18,19)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Plk1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50376346
PNG
(CHEMBL259381)
Show SMILES Nc1nc(N)c2N=C(CCNc2n1)c1cccc(Cl)c1
Show InChI InChI=1S/C13H13ClN6/c14-8-3-1-2-7(6-8)9-4-5-17-12-10(18-9)11(15)19-13(16)20-12/h1-3,6H,4-5H2,(H5,15,16,17,19,20)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
AKT/p21CIP1


(Homo sapiens (human))
BDBM50376348
PNG
(CHEMBL407532)
Show SMILES Nc1ncnc2NCCC(=Nc12)c1cccc(Cl)c1
Show InChI InChI=1S/C13H12ClN5/c14-9-3-1-2-8(6-9)10-4-5-16-13-11(19-10)12(15)17-7-18-13/h1-3,6-7H,4-5H2,(H3,15,16,17,18)
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n/an/a>1.00E+5n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Akt1


Bioorg Med Chem Lett 18: 2691-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.021
BindingDB Entry DOI: 10.7270/Q2KP831H
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%