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2 similar compounds to monomer 50316792

Compile data set for download or QSAR
Wt: 492.6
BDBM50316775
Wt: 462.5
BDBM50316776

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 8 hits for monomerid = 50316775,50316776   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Focal adhesion kinase 1/vascular endothelial growth factor receptor 3


(Homo sapiens (Human))
BDBM50316776
PNG
(2-[5-(4-Hydroxyphenethoxy)-1-(4-phenyl)benzyl-1Hin...)
Show SMILES NCCc1cn(Cc2ccc(cc2)-c2ccccc2)c2ccc(OCCc3ccc(O)cc3)cc12
Show InChI InChI=1S/C31H30N2O2/c32-18-16-27-22-33(21-24-6-10-26(11-7-24)25-4-2-1-3-5-25)31-15-14-29(20-30(27)31)35-19-17-23-8-12-28(34)13-9-23/h1-15,20,22,34H,16-19,21,32H2
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n/an/a 4.10n/an/an/an/an/an/a



Universit£t Leipzig

Curated by ChEMBL


Assay Description
Inhibition of VEGFR3 after 30 mins by chemiluminescence ELISA


Bioorg Med Chem 18: 3387-402 (2010)


Article DOI: 10.1016/j.bmc.2010.04.001
BindingDB Entry DOI: 10.7270/Q21836NT
More data for this
Ligand-Target Pair
Focal adhesion kinase 1/vascular endothelial growth factor receptor 3


(Homo sapiens (Human))
BDBM50316775
PNG
(2-[5-(4-Hydroxyphenethoxy)-1-(4-methoxyphenyl)-ben...)
Show SMILES COc1ccc(cc1)-c1ccc(Cn2cc(CCN)c3cc(OCCc4ccc(O)cc4)ccc23)cc1
Show InChI InChI=1S/C32H32N2O3/c1-36-29-12-8-26(9-13-29)25-6-2-24(3-7-25)21-34-22-27(16-18-33)31-20-30(14-15-32(31)34)37-19-17-23-4-10-28(35)11-5-23/h2-15,20,22,35H,16-19,21,33H2,1H3
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n/an/a 0.960n/an/an/an/an/an/a



Universit£t Leipzig

Curated by ChEMBL


Assay Description
Inhibition of VEGFR3 after 30 mins by chemiluminescence ELISA


Bioorg Med Chem 18: 3387-402 (2010)


Article DOI: 10.1016/j.bmc.2010.04.001
BindingDB Entry DOI: 10.7270/Q21836NT
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50316775
PNG
(2-[5-(4-Hydroxyphenethoxy)-1-(4-methoxyphenyl)-ben...)
Show SMILES COc1ccc(cc1)-c1ccc(Cn2cc(CCN)c3cc(OCCc4ccc(O)cc4)ccc23)cc1
Show InChI InChI=1S/C32H32N2O3/c1-36-29-12-8-26(9-13-29)25-6-2-24(3-7-25)21-34-22-27(16-18-33)31-20-30(14-15-32(31)34)37-19-17-23-4-10-28(35)11-5-23/h2-15,20,22,35H,16-19,21,33H2,1H3
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PubMed
n/an/a 1.30n/an/an/an/an/an/a



Universit£t Leipzig

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 30 mins by chemiluminescence ELISA


Bioorg Med Chem 18: 3387-402 (2010)


Article DOI: 10.1016/j.bmc.2010.04.001
BindingDB Entry DOI: 10.7270/Q21836NT
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))
BDBM50316776
PNG
(2-[5-(4-Hydroxyphenethoxy)-1-(4-phenyl)benzyl-1Hin...)
Show SMILES NCCc1cn(Cc2ccc(cc2)-c2ccccc2)c2ccc(OCCc3ccc(O)cc3)cc12
Show InChI InChI=1S/C31H30N2O2/c32-18-16-27-22-33(21-24-6-10-26(11-7-24)25-4-2-1-3-5-25)31-15-14-29(20-30(27)31)35-19-17-23-8-12-28(34)13-9-23/h1-15,20,22,34H,16-19,21,32H2
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n/an/a 1.20n/an/an/an/an/an/a



Universit£t Leipzig

Curated by ChEMBL


Assay Description
Noncompetitive inhibition of VEGFR2 after 30 mins by chemiluminescence ELISA in presence of 25 uM ATP


Bioorg Med Chem 18: 3387-402 (2010)


Article DOI: 10.1016/j.bmc.2010.04.001
BindingDB Entry DOI: 10.7270/Q21836NT
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50316775
PNG
(2-[5-(4-Hydroxyphenethoxy)-1-(4-methoxyphenyl)-ben...)
Show SMILES COc1ccc(cc1)-c1ccc(Cn2cc(CCN)c3cc(OCCc4ccc(O)cc4)ccc23)cc1
Show InChI InChI=1S/C32H32N2O3/c1-36-29-12-8-26(9-13-29)25-6-2-24(3-7-25)21-34-22-27(16-18-33)31-20-30(14-15-32(31)34)37-19-17-23-4-10-28(35)11-5-23/h2-15,20,22,35H,16-19,21,33H2,1H3
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n/an/a 1.80n/an/an/an/an/an/a



Universit£t Leipzig

Curated by ChEMBL


Assay Description
Noncompetitive inhibition of IGF1R after 30 mins by chemiluminescence ELISA in presence of 50 uM ATP


Bioorg Med Chem 18: 3387-402 (2010)


Article DOI: 10.1016/j.bmc.2010.04.001
BindingDB Entry DOI: 10.7270/Q21836NT
More data for this
Ligand-Target Pair
Insulin-like growth factor I receptor


(Homo sapiens (Human))
BDBM50316776
PNG
(2-[5-(4-Hydroxyphenethoxy)-1-(4-phenyl)benzyl-1Hin...)
Show SMILES NCCc1cn(Cc2ccc(cc2)-c2ccccc2)c2ccc(OCCc3ccc(O)cc3)cc12
Show InChI InChI=1S/C31H30N2O2/c32-18-16-27-22-33(21-24-6-10-26(11-7-24)25-4-2-1-3-5-25)31-15-14-29(20-30(27)31)35-19-17-23-8-12-28(34)13-9-23/h1-15,20,22,34H,16-19,21,32H2
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n/an/a 2.40n/an/an/an/an/an/a



Universit£t Leipzig

Curated by ChEMBL


Assay Description
Noncompetitive inhibition of IGF1R after 30 mins by chemiluminescence ELISA in presence of 50 uM ATP


Bioorg Med Chem 18: 3387-402 (2010)


Article DOI: 10.1016/j.bmc.2010.04.001
BindingDB Entry DOI: 10.7270/Q21836NT
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))
BDBM50316775
PNG
(2-[5-(4-Hydroxyphenethoxy)-1-(4-methoxyphenyl)-ben...)
Show SMILES COc1ccc(cc1)-c1ccc(Cn2cc(CCN)c3cc(OCCc4ccc(O)cc4)ccc23)cc1
Show InChI InChI=1S/C32H32N2O3/c1-36-29-12-8-26(9-13-29)25-6-2-24(3-7-25)21-34-22-27(16-18-33)31-20-30(14-15-32(31)34)37-19-17-23-4-10-28(35)11-5-23/h2-15,20,22,35H,16-19,21,33H2,1H3
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n/an/a 1n/an/an/an/an/an/a



Universit£t Leipzig

Curated by ChEMBL


Assay Description
Noncompetitive inhibition of VEGFR2 after 30 mins by chemiluminescence ELISA in presence of 25 uM ATP


Bioorg Med Chem 18: 3387-402 (2010)


Article DOI: 10.1016/j.bmc.2010.04.001
BindingDB Entry DOI: 10.7270/Q21836NT
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50316776
PNG
(2-[5-(4-Hydroxyphenethoxy)-1-(4-phenyl)benzyl-1Hin...)
Show SMILES NCCc1cn(Cc2ccc(cc2)-c2ccccc2)c2ccc(OCCc3ccc(O)cc3)cc12
Show InChI InChI=1S/C31H30N2O2/c32-18-16-27-22-33(21-24-6-10-26(11-7-24)25-4-2-1-3-5-25)31-15-14-29(20-30(27)31)35-19-17-23-8-12-28(34)13-9-23/h1-15,20,22,34H,16-19,21,32H2
PDB
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PC sid
UniChem

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Article
PubMed
n/an/a 1.30n/an/an/an/an/an/a



Universit£t Leipzig

Curated by ChEMBL


Assay Description
Inhibition of EGFR after 30 mins by chemiluminescence ELISA


Bioorg Med Chem 18: 3387-402 (2010)


Article DOI: 10.1016/j.bmc.2010.04.001
BindingDB Entry DOI: 10.7270/Q21836NT
More data for this
Ligand-Target Pair