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Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)' and Ligand = 'BDBM50177834'   
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
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50177834
PNG
(2-Methoxy-5-{[6-methoxy-7-(3-pyrrolidin-1-ylpropox...)
Show SMILES COC1=CC(=O)C(Nc2ncnc3cc(OCCCN4CCCC4)c(OC)cc23)=CC1=O |c:31,t:2|
Show InChI InChI=1S/C23H26N4O5/c1-30-20-13-18(28)17(11-19(20)29)26-23-15-10-21(31-2)22(12-16(15)24-14-25-23)32-9-5-8-27-6-3-4-7-27/h10-14H,3-9H2,1-2H3,(H,24,25,26)
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n/an/a 3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory activity against VEGF stimulated autophosphorylation of VEGFR2 expressed in KDR15 cells


J Med Chem 48: 7560-81 (2005)


Article DOI: 10.1021/jm050559f
BindingDB Entry DOI: 10.7270/Q2028R3S
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))
BDBM50177834
PNG
(2-Methoxy-5-{[6-methoxy-7-(3-pyrrolidin-1-ylpropox...)
Show SMILES COC1=CC(=O)C(Nc2ncnc3cc(OCCCN4CCCC4)c(OC)cc23)=CC1=O |c:31,t:2|
Show InChI InChI=1S/C23H26N4O5/c1-30-20-13-18(28)17(11-19(20)29)26-23-15-10-21(31-2)22(12-16(15)24-14-25-23)32-9-5-8-27-6-3-4-7-27/h10-14H,3-9H2,1-2H3,(H,24,25,26)
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n/an/a 159n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of poly(Glu4-Tyr)peptide phosphorylation by recombinant VEGFR2 at 10 uM ATP and in presence of 5% mouse plasma


J Med Chem 48: 7560-81 (2005)


Article DOI: 10.1021/jm050559f
BindingDB Entry DOI: 10.7270/Q2028R3S
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))
BDBM50177834
PNG
(2-Methoxy-5-{[6-methoxy-7-(3-pyrrolidin-1-ylpropox...)
Show SMILES COC1=CC(=O)C(Nc2ncnc3cc(OCCCN4CCCC4)c(OC)cc23)=CC1=O |c:31,t:2|
Show InChI InChI=1S/C23H26N4O5/c1-30-20-13-18(28)17(11-19(20)29)26-23-15-10-21(31-2)22(12-16(15)24-14-25-23)32-9-5-8-27-6-3-4-7-27/h10-14H,3-9H2,1-2H3,(H,24,25,26)
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n/an/a 272n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of poly(Glu4-Tyr)peptide phosphorylation by recombinant VEGFR2 at 10 uM ATP


J Med Chem 48: 7560-81 (2005)


Article DOI: 10.1021/jm050559f
BindingDB Entry DOI: 10.7270/Q2028R3S
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))
BDBM50177834
PNG
(2-Methoxy-5-{[6-methoxy-7-(3-pyrrolidin-1-ylpropox...)
Show SMILES COC1=CC(=O)C(Nc2ncnc3cc(OCCCN4CCCC4)c(OC)cc23)=CC1=O |c:31,t:2|
Show InChI InChI=1S/C23H26N4O5/c1-30-20-13-18(28)17(11-19(20)29)26-23-15-10-21(31-2)22(12-16(15)24-14-25-23)32-9-5-8-27-6-3-4-7-27/h10-14H,3-9H2,1-2H3,(H,24,25,26)
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n/an/a 406n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of poly(Glu4-Tyr)peptide phosphorylation by recombinant VEGFR2 at 10 uM ATP and in presence of 100 uM glutathione


J Med Chem 48: 7560-81 (2005)


Article DOI: 10.1021/jm050559f
BindingDB Entry DOI: 10.7270/Q2028R3S
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))
BDBM50177834
PNG
(2-Methoxy-5-{[6-methoxy-7-(3-pyrrolidin-1-ylpropox...)
Show SMILES COC1=CC(=O)C(Nc2ncnc3cc(OCCCN4CCCC4)c(OC)cc23)=CC1=O |c:31,t:2|
Show InChI InChI=1S/C23H26N4O5/c1-30-20-13-18(28)17(11-19(20)29)26-23-15-10-21(31-2)22(12-16(15)24-14-25-23)32-9-5-8-27-6-3-4-7-27/h10-14H,3-9H2,1-2H3,(H,24,25,26)
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n/an/a 1.27E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibitory activity against VEGF stimulated autophosphorylation of VEGFR2 expressed in KDR15 cells


J Med Chem 48: 7560-81 (2005)


Article DOI: 10.1021/jm050559f
BindingDB Entry DOI: 10.7270/Q2028R3S
More data for this
Ligand-Target Pair