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PubMed code 18467105

Compile data set for download or QSAR
Found 71 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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271908
PNG
(CHEMBL502015 | N4-(3-bromophenyl)-2-(naphthalen-2-...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccc4ccccc4c3)[nH]c2n1
Show InChI InChI=1S/C23H18BrN5/c24-17-6-3-7-18(12-17)26-21-20-13-19(27-22(20)29-23(25)28-21)11-14-8-9-15-4-1-2-5-16(15)10-14/h1-10,12-13H,11H2,(H4,25,26,27,28,29)
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n/an/a 1.24E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271906
PNG
(2-benzyl-N4-(3-bromophenyl)-1H-indole-4,6-diamine ...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C19H16BrN5/c20-13-7-4-8-14(10-13)22-17-16-11-15(9-12-5-2-1-3-6-12)23-18(16)25-19(21)24-17/h1-8,10-11H,9H2,(H4,21,22,23,24,25)
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n/an/a 1.67E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271759
PNG
(CHEMBL485321 | N4-(3-Bromophenyl)-6-[2-(4-methoxyp...)
Show SMILES COc1ccc(CCc2cc3c(Nc4cccc(Br)c4)nc(N)nc3[nH]2)cc1
Show InChI InChI=1S/C21H20BrN5O/c1-28-17-9-6-13(7-10-17)5-8-16-12-18-19(26-21(23)27-20(18)25-16)24-15-4-2-3-14(22)11-15/h2-4,6-7,9-12H,5,8H2,1H3,(H4,23,24,25,26,27)
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n/an/a 2.20E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271851
PNG
(CHEMBL519147 | N4-(4-Chlorophenyl)-6-(2-phenylethy...)
Show SMILES Nc1nc(Nc2ccc(Cl)cc2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H18ClN5/c21-14-7-10-15(11-8-14)23-18-17-12-16(24-19(17)26-20(22)25-18)9-6-13-4-2-1-3-5-13/h1-5,7-8,10-12H,6,9H2,(H4,22,23,24,25,26)
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n/an/a 3.18E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271760
PNG
(CHEMBL482489 | N4-(3-Bromophenyl)-6-[2-(2-chloroph...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccccc3Cl)[nH]c2n1
Show InChI InChI=1S/C20H17BrClN5/c21-13-5-3-6-14(10-13)24-18-16-11-15(25-19(16)27-20(23)26-18)9-8-12-4-1-2-7-17(12)22/h1-7,10-11H,8-9H2,(H4,23,24,25,26,27)
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n/an/a 3.40E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271907
PNG
(2-(2-chlorobenzyl)-N4-(3-bromophenyl)-1H-indole-4,...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccccc3Cl)[nH]c2n1
Show InChI InChI=1S/C19H15BrClN5/c20-12-5-3-6-13(9-12)23-17-15-10-14(24-18(15)26-19(22)25-17)8-11-4-1-2-7-16(11)21/h1-7,9-10H,8H2,(H4,22,23,24,25,26)
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n/an/a 4.31E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271762
PNG
(CHEMBL484109 | N4-(3-Bromophenyl)-6-[2-(2-naphthyl...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccc4ccccc4c3)[nH]c2n1
Show InChI InChI=1S/C24H20BrN5/c25-18-6-3-7-19(13-18)27-22-21-14-20(28-23(21)30-24(26)29-22)11-9-15-8-10-16-4-1-2-5-17(16)12-15/h1-8,10,12-14H,9,11H2,(H4,26,27,28,29,30)
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n/an/a 4.70E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271761
PNG
(CHEMBL484108 | N4-(3-Bromophenyl)-6-[2-(1-naphthyl...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3cccc4ccccc34)[nH]c2n1
Show InChI InChI=1S/C24H20BrN5/c25-17-8-4-9-18(13-17)27-22-21-14-19(28-23(21)30-24(26)29-22)12-11-16-7-3-6-15-5-1-2-10-20(15)16/h1-10,13-14H,11-12H2,(H4,26,27,28,29,30)
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n/an/a 4.80E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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))
BDBM50247802
PNG
(CHEMBL474538 | N4-(3-bromophenyl)-2-(naphthalen-1-...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3cccc4ccccc34)[nH]c2n1
Show InChI InChI=1S/C23H18BrN5/c24-16-8-4-9-17(12-16)26-21-20-13-18(27-22(20)29-23(25)28-21)11-15-7-3-6-14-5-1-2-10-19(14)15/h1-10,12-13H,11H2,(H4,25,26,27,28,29)
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n/an/a 5.08E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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))
BDBM50271907
PNG
(2-(2-chlorobenzyl)-N4-(3-bromophenyl)-1H-indole-4,...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccccc3Cl)[nH]c2n1
Show InChI InChI=1S/C19H15BrClN5/c20-12-5-3-6-13(9-12)23-17-15-10-14(24-18(15)26-19(22)25-17)8-11-4-1-2-7-16(11)21/h1-7,9-10H,8H2,(H4,22,23,24,25,26)
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n/an/a 5.58E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 6.20E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271762
PNG
(CHEMBL484109 | N4-(3-Bromophenyl)-6-[2-(2-naphthyl...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccc4ccccc4c3)[nH]c2n1
Show InChI InChI=1S/C24H20BrN5/c25-18-6-3-7-19(13-18)27-22-21-14-20(28-23(21)30-24(26)29-22)11-9-15-8-10-16-4-1-2-5-17(16)12-15/h1-8,10,12-14H,9,11H2,(H4,26,27,28,29,30)
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n/an/a 7.80E+3n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271761
PNG
(CHEMBL484108 | N4-(3-Bromophenyl)-6-[2-(1-naphthyl...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3cccc4ccccc34)[nH]c2n1
Show InChI InChI=1S/C24H20BrN5/c25-17-8-4-9-18(13-17)27-22-21-14-19(28-23(21)30-24(26)29-22)12-11-16-7-3-6-15-5-1-2-10-20(15)16/h1-10,13-14H,11-12H2,(H4,26,27,28,29,30)
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n/an/a 1.10E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271761
PNG
(CHEMBL484108 | N4-(3-Bromophenyl)-6-[2-(1-naphthyl...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3cccc4ccccc34)[nH]c2n1
Show InChI InChI=1S/C24H20BrN5/c25-17-8-4-9-18(13-17)27-22-21-14-19(28-23(21)30-24(26)29-22)12-11-16-7-3-6-15-5-1-2-10-20(15)16/h1-10,13-14H,11-12H2,(H4,26,27,28,29,30)
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n/an/a 1.12E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271762
PNG
(CHEMBL484109 | N4-(3-Bromophenyl)-6-[2-(2-naphthyl...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccc4ccccc4c3)[nH]c2n1
Show InChI InChI=1S/C24H20BrN5/c25-18-6-3-7-19(13-18)27-22-21-14-20(28-23(21)30-24(26)29-22)11-9-15-8-10-16-4-1-2-5-17(16)12-15/h1-8,10,12-14H,9,11H2,(H4,26,27,28,29,30)
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n/an/a 1.37E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271908
PNG
(CHEMBL502015 | N4-(3-bromophenyl)-2-(naphthalen-2-...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccc4ccccc4c3)[nH]c2n1
Show InChI InChI=1S/C23H18BrN5/c24-17-6-3-7-18(12-17)26-21-20-13-19(27-22(20)29-23(25)28-21)11-14-8-9-15-4-1-2-5-16(15)10-14/h1-10,12-13H,11H2,(H4,25,26,27,28,29)
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n/an/a 1.52E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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))
BDBM50271762
PNG
(CHEMBL484109 | N4-(3-Bromophenyl)-6-[2-(2-naphthyl...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccc4ccccc4c3)[nH]c2n1
Show InChI InChI=1S/C24H20BrN5/c25-18-6-3-7-19(13-18)27-22-21-14-20(28-23(21)30-24(26)29-22)11-9-15-8-10-16-4-1-2-5-17(16)12-15/h1-8,10,12-14H,9,11H2,(H4,26,27,28,29,30)
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n/an/a 1.68E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50247802
PNG
(CHEMBL474538 | N4-(3-bromophenyl)-2-(naphthalen-1-...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3cccc4ccccc34)[nH]c2n1
Show InChI InChI=1S/C23H18BrN5/c24-16-8-4-9-17(12-16)26-21-20-13-18(27-22(20)29-23(25)28-21)11-15-7-3-6-14-5-1-2-10-19(14)15/h1-10,12-13H,11H2,(H4,25,26,27,28,29)
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n/an/a 1.92E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50271804
PNG
(CHEMBL504416 | N4-(3-Chloro-4-fluorophenyl)-6-(2-p...)
Show SMILES Nc1nc(Nc2ccc(F)c(Cl)c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H17ClFN5/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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271907
PNG
(2-(2-chlorobenzyl)-N4-(3-bromophenyl)-1H-indole-4,...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccccc3Cl)[nH]c2n1
Show InChI InChI=1S/C19H15BrClN5/c20-12-5-3-6-13(9-12)23-17-15-10-14(24-18(15)26-19(22)25-17)8-11-4-1-2-7-16(11)21/h1-7,9-10H,8H2,(H4,22,23,24,25,26)
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n/an/a 2.68E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271759
PNG
(CHEMBL485321 | N4-(3-Bromophenyl)-6-[2-(4-methoxyp...)
Show SMILES COc1ccc(CCc2cc3c(Nc4cccc(Br)c4)nc(N)nc3[nH]2)cc1
Show InChI InChI=1S/C21H20BrN5O/c1-28-17-9-6-13(7-10-17)5-8-16-12-18-19(26-21(23)27-20(18)25-16)24-15-4-2-3-14(22)11-15/h2-4,6-7,9-12H,5,8H2,1H3,(H4,23,24,25,26,27)
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n/an/a 3.18E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271760
PNG
(CHEMBL482489 | N4-(3-Bromophenyl)-6-[2-(2-chloroph...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccccc3Cl)[nH]c2n1
Show InChI InChI=1S/C20H17BrClN5/c21-13-5-3-6-14(10-13)24-18-16-11-15(25-19(16)27-20(23)26-18)9-8-12-4-1-2-7-17(12)22/h1-7,10-11H,8-9H2,(H4,23,24,25,26,27)
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n/an/a 3.27E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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))
BDBM50271760
PNG
(CHEMBL482489 | N4-(3-Bromophenyl)-6-[2-(2-chloroph...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccccc3Cl)[nH]c2n1
Show InChI InChI=1S/C20H17BrClN5/c21-13-5-3-6-14(10-13)24-18-16-11-15(25-19(16)27-20(23)26-18)9-8-12-4-1-2-7-17(12)22/h1-7,10-11H,8-9H2,(H4,23,24,25,26,27)
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n/an/a 4.23E+4n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271906
PNG
(2-benzyl-N4-(3-bromophenyl)-1H-indole-4,6-diamine ...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C19H16BrN5/c20-13-7-4-8-14(10-13)22-17-16-11-15(9-12-5-2-1-3-6-12)23-18(16)25-19(21)24-17/h1-8,10-11H,9H2,(H4,21,22,23,24,25)
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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 VEGFR1 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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))
BDBM50271906
PNG
(2-benzyl-N4-(3-bromophenyl)-1H-indole-4,6-diamine ...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C19H16BrN5/c20-13-7-4-8-14(10-13)22-17-16-11-15(9-12-5-2-1-3-6-12)23-18(16)25-19(21)24-17/h1-8,10-11H,9H2,(H4,21,22,23,24,25)
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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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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))
BDBM50271759
PNG
(CHEMBL485321 | N4-(3-Bromophenyl)-6-[2-(4-methoxyp...)
Show SMILES COc1ccc(CCc2cc3c(Nc4cccc(Br)c4)nc(N)nc3[nH]2)cc1
Show InChI InChI=1S/C21H20BrN5O/c1-28-17-9-6-13(7-10-17)5-8-16-12-18-19(26-21(23)27-20(18)25-16)24-15-4-2-3-14(22)11-15/h2-4,6-7,9-12H,5,8H2,1H3,(H4,23,24,25,26,27)
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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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50247802
PNG
(CHEMBL474538 | N4-(3-bromophenyl)-2-(naphthalen-1-...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3cccc4ccccc34)[nH]c2n1
Show InChI InChI=1S/C23H18BrN5/c24-16-8-4-9-17(12-16)26-21-20-13-18(27-22(20)29-23(25)28-21)11-15-7-3-6-14-5-1-2-10-19(14)15/h1-10,12-13H,11H2,(H4,25,26,27,28,29)
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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 EGFR (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271908
PNG
(CHEMBL502015 | N4-(3-bromophenyl)-2-(naphthalen-2-...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccc4ccccc4c3)[nH]c2n1
Show InChI InChI=1S/C23H18BrN5/c24-17-6-3-7-18(12-17)26-21-20-13-19(27-22(20)29-23(25)28-21)11-14-8-9-15-4-1-2-5-16(15)10-14/h1-10,12-13H,11H2,(H4,25,26,27,28,29)
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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 PDGFRbeta (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271906
PNG
(2-benzyl-N4-(3-bromophenyl)-1H-indole-4,6-diamine ...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C19H16BrN5/c20-13-7-4-8-14(10-13)22-17-16-11-15(9-12-5-2-1-3-6-12)23-18(16)25-19(21)24-17/h1-8,10-11H,9H2,(H4,21,22,23,24,25)
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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 PDGFRbeta (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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))
BDBM50271908
PNG
(CHEMBL502015 | N4-(3-bromophenyl)-2-(naphthalen-2-...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccc4ccccc4c3)[nH]c2n1
Show InChI InChI=1S/C23H18BrN5/c24-17-6-3-7-18(12-17)26-21-20-13-19(27-22(20)29-23(25)28-21)11-14-8-9-15-4-1-2-5-16(15)10-14/h1-10,12-13H,11H2,(H4,25,26,27,28,29)
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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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271907
PNG
(2-(2-chlorobenzyl)-N4-(3-bromophenyl)-1H-indole-4,...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3ccccc3Cl)[nH]c2n1
Show InChI InChI=1S/C19H15BrClN5/c20-12-5-3-6-13(9-12)23-17-15-10-14(24-18(15)26-19(22)25-17)8-11-4-1-2-7-16(11)21/h1-7,9-10H,8H2,(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 PDGFRbeta (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271759
PNG
(CHEMBL485321 | N4-(3-Bromophenyl)-6-[2-(4-methoxyp...)
Show SMILES COc1ccc(CCc2cc3c(Nc4cccc(Br)c4)nc(N)nc3[nH]2)cc1
Show InChI InChI=1S/C21H20BrN5O/c1-28-17-9-6-13(7-10-17)5-8-16-12-18-19(26-21(23)27-20(18)25-16)24-15-4-2-3-14(22)11-15/h2-4,6-7,9-12H,5,8H2,1H3,(H4,23,24,25,26,27)
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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 PDGFRbeta (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271760
PNG
(CHEMBL482489 | N4-(3-Bromophenyl)-6-[2-(2-chloroph...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(CCc3ccccc3Cl)[nH]c2n1
Show InChI InChI=1S/C20H17BrClN5/c21-13-5-3-6-14(10-13)24-18-16-11-15(25-19(16)27-20(23)26-18)9-8-12-4-1-2-7-17(12)22/h1-7,10-11H,8-9H2,(H4,23,24,25,26,27)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50247802
PNG
(CHEMBL474538 | N4-(3-bromophenyl)-2-(naphthalen-1-...)
Show SMILES Nc1nc(Nc2cccc(Br)c2)c2cc(Cc3cccc4ccccc34)[nH]c2n1
Show InChI InChI=1S/C23H18BrN5/c24-16-8-4-9-17(12-16)26-21-20-13-18(27-22(20)29-23(25)28-21)11-15-7-3-6-14-5-1-2-10-19(14)15/h1-10,12-13H,11H2,(H4,25,26,27,28,29)
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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 PDGFRbeta (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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))
BDBM50271804
PNG
(CHEMBL504416 | N4-(3-Chloro-4-fluorophenyl)-6-(2-p...)
Show SMILES Nc1nc(Nc2ccc(F)c(Cl)c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H17ClFN5/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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 1.98E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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>2.00E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271851
PNG
(CHEMBL519147 | N4-(4-Chlorophenyl)-6-(2-phenylethy...)
Show SMILES Nc1nc(Nc2ccc(Cl)cc2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H18ClN5/c21-14-7-10-15(11-8-14)23-18-17-12-16(24-19(17)26-20(22)25-18)9-6-13-4-2-1-3-5-13/h1-5,7-8,10-12H,6,9H2,(H4,22,23,24,25,26)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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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n/an/a>2.00E+5n/an/an/an/an/an/a



Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of EGFR (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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))
BDBM50271851
PNG
(CHEMBL519147 | N4-(4-Chlorophenyl)-6-(2-phenylethy...)
Show SMILES Nc1nc(Nc2ccc(Cl)cc2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H18ClN5/c21-14-7-10-15(11-8-14)23-18-17-12-16(24-19(17)26-20(22)25-18)9-6-13-4-2-1-3-5-13/h1-5,7-8,10-12H,6,9H2,(H4,22,23,24,25,26)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50271804
PNG
(CHEMBL504416 | N4-(3-Chloro-4-fluorophenyl)-6-(2-p...)
Show SMILES Nc1nc(Nc2ccc(F)c(Cl)c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H17ClFN5/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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271851
PNG
(CHEMBL519147 | N4-(4-Chlorophenyl)-6-(2-phenylethy...)
Show SMILES Nc1nc(Nc2ccc(Cl)cc2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H18ClN5/c21-14-7-10-15(11-8-14)23-18-17-12-16(24-19(17)26-20(22)25-18)9-6-13-4-2-1-3-5-13/h1-5,7-8,10-12H,6,9H2,(H4,22,23,24,25,26)
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Duquesne University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50271804
PNG
(CHEMBL504416 | N4-(3-Chloro-4-fluorophenyl)-6-(2-p...)
Show SMILES Nc1nc(Nc2ccc(F)c(Cl)c2)c2cc(CCc3ccccc3)[nH]c2n1
Show InChI InChI=1S/C20H17ClFN5/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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
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 (unknown origin) expressed in human tumor cells


Bioorg Med Chem 16: 5514-28 (2008)


Article DOI: 10.1016/j.bmc.2008.04.019
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%