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PubMed code 20403693

Compile data set for download or QSAR
Found 60 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
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM3032
PNG
(CHEMBL1204168 | CHEMBL29197 | N-(3-bromophenyl)-6,...)
Show SMILES COc1cc2ncnc(Nc3cccc(Br)c3)c2cc1OC
Show InChI InChI=1S/C16H14BrN3O2/c1-21-14-7-12-13(8-15(14)22-2)18-9-19-16(12)20-11-5-3-4-10(17)6-11/h3-9H,1-2H3,(H,18,19,20)
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n/an/a 200n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271758
PNG
(CHEMBL485320 | N4-(3-Bromophenyl)-6-(2-phenylethyl...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H18BrN5/c21-14-7-4-8-15(11-14)23-18-17-12-16(24-19(17)26-20(22)25-18)10-9-13-5-2-1-3-6-13/h1-8,11-12H,9-10H2,(H4,22,23,24,25,26)
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n/an/a 300n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271850
PNG
(CHEMBL483313 | N4-(4-chloro-2-fluorophenyl)-6-(2-p...)
Show SMILES Nc1nc(Nc2ccc(Cl)cc2F)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H17ClFN5/c21-13-7-9-17(16(22)10-13)25-19-15-11-14(24-18(15)26-20(23)27-19)8-6-12-4-2-1-3-5-12/h1-5,7,9-11H,6,8H2,(H4,23,24,25,26,27)
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n/an/a 1.32E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM33408
PNG
(AG1295 | CHEMBL7724 | cid_2048)
Show SMILES Cc1cc2ncc(nc2cc1C)-c1ccccc1
Show InChI InChI=1S/C16H14N2/c1-11-8-14-15(9-12(11)2)18-16(10-17-14)13-6-4-3-5-7-13/h3-10H,1-2H3
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n/an/a 6.50E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50318162
PNG
(CHEMBL1094423 | N-(3-bromophenyl)-6-(2-phenylethyl...)
Show SMILES Brc1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
Show InChI InChI=1S/C20H17BrN4/c21-15-7-4-8-16(11-15)24-19-18-12-17(25-20(18)23-13-22-19)10-9-14-5-2-1-3-6-14/h1-8,11-13H,9-10H2,(H2,22,23,24,25)
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n/an/a 8.50E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM4810
PNG
((3Z)-3-[(3,5-dimethyl-1H-pyrrol-2-yl)methylidene]-...)
Show SMILES Cc1cc(C)c(\C=C2/C(=O)Nc3ccccc23)[nH]1
Show InChI InChI=1S/C15H14N2O/c1-9-7-10(2)16-14(9)8-12-11-5-3-4-6-13(11)17-15(12)18/h3-8,16H,1-2H3,(H,17,18)/b12-8-
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n/an/a 1.06E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271758
PNG
(CHEMBL485320 | N4-(3-Bromophenyl)-6-(2-phenylethyl...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H18BrN5/c21-14-7-4-8-15(11-14)23-18-17-12-16(24-19(17)26-20(22)25-18)10-9-13-5-2-1-3-6-13/h1-8,11-12H,9-10H2,(H4,22,23,24,25,26)
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n/an/a 1.18E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM4621
PNG
(Anilinoquinazoline deriv. 4 | CHEMBL150315 | N-(4-...)
Show SMILES COc1cc2ncnc(Nc3ccc(Cl)cc3F)c2cc1OC
Show InChI InChI=1S/C16H13ClFN3O2/c1-22-14-6-10-13(7-15(14)23-2)19-8-20-16(10)21-12-4-3-9(17)5-11(12)18/h3-8H,1-2H3,(H,19,20,21)
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n/an/a 1.77E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50318164
PNG
(6-(2-Phenylethyl)-N-[3-(trifluoromethyl)phenyl]-7H...)
Show SMILES FC(F)(F)c1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
Show InChI InChI=1S/C21H17F3N4/c22-21(23,24)15-7-4-8-16(11-15)27-19-18-12-17(28-20(18)26-13-25-19)10-9-14-5-2-1-3-6-14/h1-8,11-13H,9-10H2,(H2,25,26,27,28)
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n/an/a 2.21E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271803
PNG
(CHEMBL483108 | N4-(3-bromo-4-fluorophenyl)-6-(2-ph...)
Show SMILES Nc1nc(Nc2ccc(F)c(Br)c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H17BrFN5/c21-16-11-14(8-9-17(16)22)25-19-15-10-13(24-18(15)26-20(23)27-19)7-6-12-4-2-1-3-5-12/h1-5,8-11H,6-7H2,(H4,23,24,25,26,27)
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n/an/a 2.28E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50271905
PNG
(CHEMBL499067 | N4-(1H-indol-5-yl)-6-phenethyl-7H-p...)
Show SMILES Nc1nc(Nc2ccc3[nH]ccc3c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C22H20N6/c23-22-27-20(25-16-8-9-19-15(12-16)10-11-24-19)18-13-17(26-21(18)28-22)7-6-14-4-2-1-3-5-14/h1-5,8-13,24H,6-7H2,(H4,23,25,26,27,28)
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n/an/a 2.49E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50318165
PNG
(CHEMBL1096737 | N-(3-bromo-4-flurophenyl)-6-(2-phe...)
Show SMILES Fc1ccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)cc1Br
Show InChI InChI=1S/C20H16BrFN4/c21-17-11-15(8-9-18(17)22)26-20-16-10-14(25-19(16)23-12-24-20)7-6-13-4-2-1-3-5-13/h1-5,8-12H,6-7H2,(H2,23,24,25,26)
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n/an/a 2.52E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50318168
PNG
(CHEMBL1097368 | N-1H-indol-5-yl-6-(2-phenylethyl)-...)
Show SMILES C(Cc1ccccc1)c1cc2c(Nc3ccc4[nH]ccc4c3)ncnc2[nH]1
Show InChI InChI=1S/C22H19N5/c1-2-4-15(5-3-1)6-7-18-13-19-21(24-14-25-22(19)27-18)26-17-8-9-20-16(12-17)10-11-23-20/h1-5,8-14,23H,6-7H2,(H2,24,25,26,27)
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n/an/a 3.16E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50318167
PNG
(CHEMBL1096416 | N-(4-chloro-2-fluorophenyl)-6-(2-p...)
Show SMILES Fc1cc(Cl)ccc1Nc1ncnc2[nH]c(CCc3ccccc3)cc12
Show InChI InChI=1S/C20H16ClFN4/c21-14-7-9-18(17(22)10-14)26-20-16-11-15(25-19(16)23-12-24-20)8-6-13-4-2-1-3-5-13/h1-5,7,9-12H,6,8H2,(H2,23,24,25,26)
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n/an/a 4.05E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271758
PNG
(CHEMBL485320 | N4-(3-Bromophenyl)-6-(2-phenylethyl...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H18BrN5/c21-14-7-4-8-15(11-14)23-18-17-12-16(24-19(17)26-20(22)25-18)10-9-13-5-2-1-3-6-13/h1-8,11-12H,9-10H2,(H4,22,23,24,25,26)
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n/an/a 4.51E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50318163
PNG
(CHEMBL1096972 | N-(3-ethynylphenyl)-6-(2-phenyleth...)
Show SMILES C#Cc1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
Show InChI InChI=1S/C22H18N4/c1-2-16-9-6-10-18(13-16)25-21-20-14-19(26-22(20)24-15-23-21)12-11-17-7-4-3-5-8-17/h1,3-10,13-15H,11-12H2,(H2,23,24,25,26)
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n/an/a 4.94E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50271758
PNG
(CHEMBL485320 | N4-(3-Bromophenyl)-6-(2-phenylethyl...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H18BrN5/c21-14-7-4-8-15(11-14)23-18-17-12-16(24-19(17)26-20(22)25-18)10-9-13-5-2-1-3-6-13/h1-8,11-12H,9-10H2,(H4,22,23,24,25,26)
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n/an/a>5.00E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50318168
PNG
(CHEMBL1097368 | N-1H-indol-5-yl-6-(2-phenylethyl)-...)
Show SMILES C(Cc1ccccc1)c1cc2c(Nc3ccc4[nH]ccc4c3)ncnc2[nH]1
Show InChI InChI=1S/C22H19N5/c1-2-4-15(5-3-1)6-7-18-13-19-21(24-14-25-22(19)27-18)26-17-8-9-20-16(12-17)10-11-23-20/h1-5,8-14,23H,6-7H2,(H2,24,25,26,27)
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n/an/a 5.61E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50318166
PNG
(CHEMBL1096415 | N-[4-fluoro-3-(trifluoromethyl)phe...)
Show SMILES Fc1ccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)cc1C(F)(F)F
Show InChI InChI=1S/C21H16F4N4/c22-18-9-8-15(11-17(18)21(23,24)25)29-20-16-10-14(28-19(16)26-12-27-20)7-6-13-4-2-1-3-5-13/h1-5,8-12H,6-7H2,(H2,26,27,28,29)
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n/an/a 5.75E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271905
PNG
(CHEMBL499067 | N4-(1H-indol-5-yl)-6-phenethyl-7H-p...)
Show SMILES Nc1nc(Nc2ccc3[nH]ccc3c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C22H20N6/c23-22-27-20(25-16-8-9-19-15(12-16)10-11-24-19)18-13-17(26-21(18)28-22)7-6-14-4-2-1-3-5-14/h1-5,8-13,24H,6-7H2,(H4,23,25,26,27,28)
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n/an/a 7.74E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271852
PNG
(CHEMBL482715 | N4-(4-fluoro-3-(trifluoromethyl)phe...)
Show SMILES Nc1nc(Nc2ccc(F)c(c2)C(F)(F)F)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C21H17F4N5/c22-17-9-8-14(11-16(17)21(23,24)25)28-19-15-10-13(27-18(15)29-20(26)30-19)7-6-12-4-2-1-3-5-12/h1-5,8-11H,6-7H2,(H4,26,27,28,29,30)
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n/an/a 9.00E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271849
PNG
(CHEMBL520803 | N4-(3-Ethynylphenyl)-6-(2-phenyleth...)
Show SMILES Nc1nc(Nc2cccc(c2)C#C)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C22H19N5/c1-2-15-9-6-10-17(13-15)24-20-19-14-18(25-21(19)27-22(23)26-20)12-11-16-7-4-3-5-8-16/h1,3-10,13-14H,11-12H2,(H4,23,24,25,26,27)
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n/an/a 1.00E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50318168
PNG
(CHEMBL1097368 | N-1H-indol-5-yl-6-(2-phenylethyl)-...)
Show SMILES C(Cc1ccccc1)c1cc2c(Nc3ccc4[nH]ccc4c3)ncnc2[nH]1
Show InChI InChI=1S/C22H19N5/c1-2-4-15(5-3-1)6-7-18-13-19-21(24-14-25-22(19)27-18)26-17-8-9-20-16(12-17)10-11-23-20/h1-5,8-14,23H,6-7H2,(H2,24,25,26,27)
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n/an/a 1.04E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50318162
PNG
(CHEMBL1094423 | N-(3-bromophenyl)-6-(2-phenylethyl...)
Show SMILES Brc1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
Show InChI InChI=1S/C20H17BrN4/c21-15-7-4-8-16(11-15)24-19-18-12-17(25-20(18)23-13-22-19)10-9-14-5-2-1-3-6-14/h1-8,11-13H,9-10H2,(H2,22,23,24,25)
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n/an/a 1.12E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271852
PNG
(CHEMBL482715 | N4-(4-fluoro-3-(trifluoromethyl)phe...)
Show SMILES Nc1nc(Nc2ccc(F)c(c2)C(F)(F)F)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C21H17F4N5/c22-17-9-8-14(11-16(17)21(23,24)25)28-19-15-10-13(27-18(15)29-20(26)30-19)7-6-12-4-2-1-3-5-12/h1-5,8-11H,6-7H2,(H4,26,27,28,29,30)
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n/an/a 1.22E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50318162
PNG
(CHEMBL1094423 | N-(3-bromophenyl)-6-(2-phenylethyl...)
Show SMILES Brc1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
Show InChI InChI=1S/C20H17BrN4/c21-15-7-4-8-16(11-15)24-19-18-12-17(25-20(18)23-13-22-19)10-9-14-5-2-1-3-6-14/h1-8,11-13H,9-10H2,(H2,22,23,24,25)
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n/an/a 1.29E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50271803
PNG
(CHEMBL483108 | N4-(3-bromo-4-fluorophenyl)-6-(2-ph...)
Show SMILES Nc1nc(Nc2ccc(F)c(Br)c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H17BrFN5/c21-16-11-14(8-9-17(16)22)25-19-15-10-13(24-18(15)26-20(23)27-19)7-6-12-4-2-1-3-5-12/h1-5,8-11H,6-7H2,(H4,23,24,25,26,27)
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n/an/a 1.32E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50318163
PNG
(CHEMBL1096972 | N-(3-ethynylphenyl)-6-(2-phenyleth...)
Show SMILES C#Cc1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
Show InChI InChI=1S/C22H18N4/c1-2-16-9-6-10-18(13-16)25-21-20-14-19(26-22(20)24-15-23-21)12-11-17-7-4-3-5-8-17/h1,3-10,13-15H,11-12H2,(H2,23,24,25,26)
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n/an/a 1.42E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50318166
PNG
(CHEMBL1096415 | N-[4-fluoro-3-(trifluoromethyl)phe...)
Show SMILES Fc1ccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)cc1C(F)(F)F
Show InChI InChI=1S/C21H16F4N4/c22-18-9-8-15(11-17(18)21(23,24)25)29-20-16-10-14(28-19(16)26-12-27-20)7-6-13-4-2-1-3-5-13/h1-5,8-12H,6-7H2,(H2,26,27,28,29)
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n/an/a 1.64E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50318165
PNG
(CHEMBL1096737 | N-(3-bromo-4-flurophenyl)-6-(2-phe...)
Show SMILES Fc1ccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)cc1Br
Show InChI InChI=1S/C20H16BrFN4/c21-17-11-15(8-9-18(17)22)26-20-16-10-14(25-19(16)23-12-24-20)7-6-13-4-2-1-3-5-13/h1-5,8-12H,6-7H2,(H2,23,24,25,26)
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n/an/a 1.92E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50318167
PNG
(CHEMBL1096416 | N-(4-chloro-2-fluorophenyl)-6-(2-p...)
Show SMILES Fc1cc(Cl)ccc1Nc1ncnc2[nH]c(CCc3ccccc3)cc12
Show InChI InChI=1S/C20H16ClFN4/c21-14-7-9-18(17(22)10-14)26-20-16-11-15(25-19(16)23-12-24-20)8-6-13-4-2-1-3-5-13/h1-5,7,9-12H,6,8H2,(H2,23,24,25,26)
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n/an/a>2.00E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50318166
PNG
(CHEMBL1096415 | N-[4-fluoro-3-(trifluoromethyl)phe...)
Show SMILES Fc1ccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)cc1C(F)(F)F
Show InChI InChI=1S/C21H16F4N4/c22-18-9-8-15(11-17(18)21(23,24)25)29-20-16-10-14(28-19(16)26-12-27-20)7-6-13-4-2-1-3-5-13/h1-5,8-12H,6-7H2,(H2,26,27,28,29)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50318165
PNG
(CHEMBL1096737 | N-(3-bromo-4-flurophenyl)-6-(2-phe...)
Show SMILES Fc1ccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)cc1Br
Show InChI InChI=1S/C20H16BrFN4/c21-17-11-15(8-9-18(17)22)26-20-16-10-14(25-19(16)23-12-24-20)7-6-13-4-2-1-3-5-13/h1-5,8-12H,6-7H2,(H2,23,24,25,26)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271850
PNG
(CHEMBL483313 | N4-(4-chloro-2-fluorophenyl)-6-(2-p...)
Show SMILES Nc1nc(Nc2ccc(Cl)cc2F)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H17ClFN5/c21-13-7-9-17(16(22)10-13)25-19-15-11-14(24-18(15)26-20(23)27-19)8-6-12-4-2-1-3-5-12/h1-5,7,9-11H,6,8H2,(H4,23,24,25,26,27)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50318167
PNG
(CHEMBL1096416 | N-(4-chloro-2-fluorophenyl)-6-(2-p...)
Show SMILES Fc1cc(Cl)ccc1Nc1ncnc2[nH]c(CCc3ccccc3)cc12
Show InChI InChI=1S/C20H16ClFN4/c21-14-7-9-18(17(22)10-14)26-20-16-11-15(25-19(16)23-12-24-20)8-6-13-4-2-1-3-5-13/h1-5,7,9-12H,6,8H2,(H2,23,24,25,26)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271848
PNG
(6-phenethyl-N4-(3-(trifluoromethyl)phenyl)-7H-pyrr...)
Show SMILES Nc1nc(Nc2cccc(c2)C(F)(F)F)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C21H18F3N5/c22-21(23,24)14-7-4-8-15(11-14)26-18-17-12-16(27-19(17)29-20(25)28-18)10-9-13-5-2-1-3-6-13/h1-8,11-12H,9-10H2,(H4,25,26,27,28,29)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50318164
PNG
(6-(2-Phenylethyl)-N-[3-(trifluoromethyl)phenyl]-7H...)
Show SMILES FC(F)(F)c1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
Show InChI InChI=1S/C21H17F3N4/c22-21(23,24)15-7-4-8-16(11-15)27-19-18-12-17(28-20(18)26-13-25-19)10-9-14-5-2-1-3-6-14/h1-8,11-13H,9-10H2,(H2,25,26,27,28)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50318162
PNG
(CHEMBL1094423 | N-(3-bromophenyl)-6-(2-phenylethyl...)
Show SMILES Brc1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
Show InChI InChI=1S/C20H17BrN4/c21-15-7-4-8-16(11-15)24-19-18-12-17(25-20(18)23-13-22-19)10-9-14-5-2-1-3-6-14/h1-8,11-13H,9-10H2,(H2,22,23,24,25)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50271850
PNG
(CHEMBL483313 | N4-(4-chloro-2-fluorophenyl)-6-(2-p...)
Show SMILES Nc1nc(Nc2ccc(Cl)cc2F)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H17ClFN5/c21-13-7-9-17(16(22)10-13)25-19-15-11-14(24-18(15)26-20(23)27-19)8-6-12-4-2-1-3-5-12/h1-5,7,9-11H,6,8H2,(H4,23,24,25,26,27)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50318163
PNG
(CHEMBL1096972 | N-(3-ethynylphenyl)-6-(2-phenyleth...)
Show SMILES C#Cc1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
Show InChI InChI=1S/C22H18N4/c1-2-16-9-6-10-18(13-16)25-21-20-14-19(26-22(20)24-15-23-21)12-11-17-7-4-3-5-8-17/h1,3-10,13-15H,11-12H2,(H2,23,24,25,26)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50318164
PNG
(6-(2-Phenylethyl)-N-[3-(trifluoromethyl)phenyl]-7H...)
Show SMILES FC(F)(F)c1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
Show InChI InChI=1S/C21H17F3N4/c22-21(23,24)15-7-4-8-16(11-15)27-19-18-12-17(28-20(18)26-13-25-19)10-9-14-5-2-1-3-6-14/h1-8,11-13H,9-10H2,(H2,25,26,27,28)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271848
PNG
(6-phenethyl-N4-(3-(trifluoromethyl)phenyl)-7H-pyrr...)
Show SMILES Nc1nc(Nc2cccc(c2)C(F)(F)F)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C21H18F3N5/c22-21(23,24)14-7-4-8-15(11-14)26-18-17-12-16(27-19(17)29-20(25)28-18)10-9-13-5-2-1-3-6-13/h1-8,11-12H,9-10H2,(H4,25,26,27,28,29)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50318165
PNG
(CHEMBL1096737 | N-(3-bromo-4-flurophenyl)-6-(2-phe...)
Show SMILES Fc1ccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)cc1Br
Show InChI InChI=1S/C20H16BrFN4/c21-17-11-15(8-9-18(17)22)26-20-16-10-14(25-19(16)23-12-24-20)7-6-13-4-2-1-3-5-13/h1-5,8-12H,6-7H2,(H2,23,24,25,26)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271849
PNG
(CHEMBL520803 | N4-(3-Ethynylphenyl)-6-(2-phenyleth...)
Show SMILES Nc1nc(Nc2cccc(c2)C#C)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C22H19N5/c1-2-15-9-6-10-17(13-15)24-20-19-14-18(25-21(19)27-22(23)26-20)12-11-16-7-4-3-5-8-16/h1,3-10,13-14H,11-12H2,(H4,23,24,25,26,27)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271905
PNG
(CHEMBL499067 | N4-(1H-indol-5-yl)-6-phenethyl-7H-p...)
Show SMILES Nc1nc(Nc2ccc3[nH]ccc3c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C22H20N6/c23-22-27-20(25-16-8-9-19-15(12-16)10-11-24-19)18-13-17(26-21(18)28-22)7-6-14-4-2-1-3-5-14/h1-5,8-13,24H,6-7H2,(H4,23,25,26,27,28)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271849
PNG
(CHEMBL520803 | N4-(3-Ethynylphenyl)-6-(2-phenyleth...)
Show SMILES Nc1nc(Nc2cccc(c2)C#C)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C22H19N5/c1-2-15-9-6-10-17(13-15)24-20-19-14-18(25-21(19)27-22(23)26-20)12-11-16-7-4-3-5-8-16/h1,3-10,13-14H,11-12H2,(H4,23,24,25,26,27)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50271849
PNG
(CHEMBL520803 | N4-(3-Ethynylphenyl)-6-(2-phenyleth...)
Show SMILES Nc1nc(Nc2cccc(c2)C#C)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C22H19N5/c1-2-15-9-6-10-17(13-15)24-20-19-14-18(25-21(19)27-22(23)26-20)12-11-16-7-4-3-5-8-16/h1,3-10,13-14H,11-12H2,(H4,23,24,25,26,27)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50271852
PNG
(CHEMBL482715 | N4-(4-fluoro-3-(trifluoromethyl)phe...)
Show SMILES Nc1nc(Nc2ccc(F)c(c2)C(F)(F)F)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C21H17F4N5/c22-17-9-8-14(11-16(17)21(23,24)25)28-19-15-10-13(27-18(15)29-20(26)30-19)7-6-12-4-2-1-3-5-12/h1-5,8-11H,6-7H2,(H4,26,27,28,29,30)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271803
PNG
(CHEMBL483108 | N4-(3-bromo-4-fluorophenyl)-6-(2-ph...)
Show SMILES Nc1nc(Nc2ccc(F)c(Br)c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H17BrFN5/c21-16-11-14(8-9-17(16)22)25-19-15-10-13(24-18(15)26-20(23)27-19)7-6-12-4-2-1-3-5-12/h1-5,8-11H,6-7H2,(H4,23,24,25,26,27)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271852
PNG
(CHEMBL482715 | N4-(4-fluoro-3-(trifluoromethyl)phe...)
Show SMILES Nc1nc(Nc2ccc(F)c(c2)C(F)(F)F)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C21H17F4N5/c22-17-9-8-14(11-16(17)21(23,24)25)28-19-15-10-13(27-18(15)29-20(26)30-19)7-6-12-4-2-1-3-5-12/h1-5,8-11H,6-7H2,(H4,26,27,28,29,30)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50271848
PNG
(6-phenethyl-N4-(3-(trifluoromethyl)phenyl)-7H-pyrr...)
Show SMILES Nc1nc(Nc2cccc(c2)C(F)(F)F)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C21H18F3N5/c22-21(23,24)14-7-4-8-15(11-14)26-18-17-12-16(27-19(17)29-20(25)28-18)10-9-13-5-2-1-3-6-13/h1-8,11-12H,9-10H2,(H4,25,26,27,28,29)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271905
PNG
(CHEMBL499067 | N4-(1H-indol-5-yl)-6-phenethyl-7H-p...)
Show SMILES Nc1nc(Nc2ccc3[nH]ccc3c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C22H20N6/c23-22-27-20(25-16-8-9-19-15(12-16)10-11-24-19)18-13-17(26-21(18)28-22)7-6-14-4-2-1-3-5-14/h1-5,8-13,24H,6-7H2,(H4,23,25,26,27,28)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50318168
PNG
(CHEMBL1097368 | N-1H-indol-5-yl-6-(2-phenylethyl)-...)
Show SMILES C(Cc1ccccc1)c1cc2c(Nc3ccc4[nH]ccc4c3)ncnc2[nH]1
Show InChI InChI=1S/C22H19N5/c1-2-4-15(5-3-1)6-7-18-13-19-21(24-14-25-22(19)27-18)26-17-8-9-20-16(12-17)10-11-23-20/h1-5,8-14,23H,6-7H2,(H2,24,25,26,27)
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n/an/a 2.24E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50318163
PNG
(CHEMBL1096972 | N-(3-ethynylphenyl)-6-(2-phenyleth...)
Show SMILES C#Cc1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
Show InChI InChI=1S/C22H18N4/c1-2-16-9-6-10-18(13-16)25-21-20-14-19(26-22(20)24-15-23-21)12-11-17-7-4-3-5-8-17/h1,3-10,13-15H,11-12H2,(H2,23,24,25,26)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50318167
PNG
(CHEMBL1096416 | N-(4-chloro-2-fluorophenyl)-6-(2-p...)
Show SMILES Fc1cc(Cl)ccc1Nc1ncnc2[nH]c(CCc3ccccc3)cc12
Show InChI InChI=1S/C20H16ClFN4/c21-14-7-9-18(17(22)10-14)26-20-16-11-15(25-19(16)23-12-24-20)8-6-13-4-2-1-3-5-13/h1-5,7,9-12H,6,8H2,(H2,23,24,25,26)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271850
PNG
(CHEMBL483313 | N4-(4-chloro-2-fluorophenyl)-6-(2-p...)
Show SMILES Nc1nc(Nc2ccc(Cl)cc2F)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H17ClFN5/c21-13-7-9-17(16(22)10-13)25-19-15-11-14(24-18(15)26-20(23)27-19)8-6-12-4-2-1-3-5-12/h1-5,7,9-11H,6,8H2,(H4,23,24,25,26,27)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50318164
PNG
(6-(2-Phenylethyl)-N-[3-(trifluoromethyl)phenyl]-7H...)
Show SMILES FC(F)(F)c1cccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)c1
Show InChI InChI=1S/C21H17F3N4/c22-21(23,24)15-7-4-8-16(11-15)27-19-18-12-17(28-20(18)26-13-25-19)10-9-14-5-2-1-3-6-14/h1-8,11-13H,9-10H2,(H2,25,26,27,28)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271803
PNG
(CHEMBL483108 | N4-(3-bromo-4-fluorophenyl)-6-(2-ph...)
Show SMILES Nc1nc(Nc2ccc(F)c(Br)c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H17BrFN5/c21-16-11-14(8-9-17(16)22)25-19-15-10-13(24-18(15)26-20(23)27-19)7-6-12-4-2-1-3-5-12/h1-5,8-11H,6-7H2,(H4,23,24,25,26,27)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50318166
PNG
(CHEMBL1096415 | N-[4-fluoro-3-(trifluoromethyl)phe...)
Show SMILES Fc1ccc(Nc2ncnc3[nH]c(CCc4ccccc4)cc23)cc1C(F)(F)F
Show InChI InChI=1S/C21H16F4N4/c22-18-9-8-15(11-17(18)21(23,24)25)29-20-16-10-14(28-19(16)26-12-27-20)7-6-13-4-2-1-3-5-13/h1-5,8-12H,6-7H2,(H2,26,27,28,29)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271848
PNG
(6-phenethyl-N4-(3-(trifluoromethyl)phenyl)-7H-pyrr...)
Show SMILES Nc1nc(Nc2cccc(c2)C(F)(F)F)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C21H18F3N5/c22-21(23,24)14-7-4-8-15(11-14)26-18-17-12-16(27-19(17)29-20(25)28-18)10-9-13-5-2-1-3-6-13/h1-8,11-12H,9-10H2,(H4,25,26,27,28,29)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 20: 3177-81 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.064
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%