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PubMed code 28033579

Compile data set for download or QSAR
Found 24 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))		BDBM50234190
PNG
(CHEMBL4079861)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cc(NC(=O)C=C)cc(c3)C(C)C)c2n1)N1CCN(C)CC1
Show InChI InChI=1S/C32H37N7O3/c1-7-29(40)34-23-15-22(20(2)3)16-25(17-23)39-30(41)14-21(4)26-19-33-32(36-31(26)39)35-27-9-8-24(18-28(27)42-6)38-12-10-37(5)11-13-38/h7-9,14-20H,1,10-13H2,2-6H3,(H,34,40)(H,33,35,36)
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n/an/a 24n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234176
PNG
(CHEMBL4087740)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cc(F)cc(NC(=O)C=C)c3)c2n1)N1CCN(C)CC1
Show InChI InChI=1S/C29H30FN7O3/c1-5-26(38)32-20-13-19(30)14-22(15-20)37-27(39)12-18(2)23-17-31-29(34-28(23)37)33-24-7-6-21(16-25(24)40-4)36-10-8-35(3)9-11-36/h5-7,12-17H,1,8-11H2,2-4H3,(H,32,38)(H,31,33,34)
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n/an/a 26n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234177
PNG
(CHEMBL4105621)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cc(Cl)cc(NC(=O)C=C)c3)c2n1)N1CCN(C)CC1
Show InChI InChI=1S/C29H30ClN7O3/c1-5-26(38)32-20-13-19(30)14-22(15-20)37-27(39)12-18(2)23-17-31-29(34-28(23)37)33-24-7-6-21(16-25(24)40-4)36-10-8-35(3)9-11-36/h5-7,12-17H,1,8-11H2,2-4H3,(H,32,38)(H,31,33,34)
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n/an/a 33n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234188
PNG
(CHEMBL4083486)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3ccc(C)c(NC(=O)C=C)c3)c2n1)N1CCN(C)CC1
Show InChI InChI=1S/C30H33N7O3/c1-6-27(38)32-25-16-22(8-7-19(25)2)37-28(39)15-20(3)23-18-31-30(34-29(23)37)33-24-10-9-21(17-26(24)40-5)36-13-11-35(4)12-14-36/h6-10,15-18H,1,11-14H2,2-5H3,(H,32,38)(H,31,33,34)
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n/an/a 37n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234183
PNG
(CHEMBL4086000)
Show SMILES CN1CCN(CC1)c1ccc(Nc2ncc3c(C)cc(=O)n(-c4cccc(NC(=O)C=C)c4)c3n2)cn1
Show InChI InChI=1S/C27H28N8O2/c1-4-24(36)30-19-6-5-7-21(15-19)35-25(37)14-18(2)22-17-29-27(32-26(22)35)31-20-8-9-23(28-16-20)34-12-10-33(3)11-13-34/h4-9,14-17H,1,10-13H2,2-3H3,(H,30,36)(H,29,31,32)
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n/an/a 47n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234179
PNG
(CHEMBL4095439)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cc(Br)cc(NC(=O)C=C)c3)c2n1)N1CCN(C)CC1
Show InChI InChI=1S/C29H30BrN7O3/c1-5-26(38)32-20-13-19(30)14-22(15-20)37-27(39)12-18(2)23-17-31-29(34-28(23)37)33-24-7-6-21(16-25(24)40-4)36-10-8-35(3)9-11-36/h5-7,12-17H,1,8-11H2,2-4H3,(H,32,38)(H,31,33,34)
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n/an/a 57n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234180
PNG
(CHEMBL4103194)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cc(NC(=O)C=C)cc(c3)C(F)(F)F)c2n1)N1CCN(C)C(C)C1
Show InChI InChI=1S/C31H32F3N7O3/c1-6-27(42)36-21-12-20(31(32,33)34)13-23(14-21)41-28(43)11-18(2)24-16-35-30(38-29(24)41)37-25-8-7-22(15-26(25)44-5)40-10-9-39(4)19(3)17-40/h6-8,11-16,19H,1,9-10,17H2,2-5H3,(H,36,42)(H,35,37,38)
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n/an/a 66n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234185
PNG
(CHEMBL4072048)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(NC(=O)C=C)c3)c2n1)N1CC(C)N(C)C(C)C1
Show InChI InChI=1S/C31H35N7O3/c1-7-28(39)33-22-9-8-10-24(14-22)38-29(40)13-19(2)25-16-32-31(35-30(25)38)34-26-12-11-23(15-27(26)41-6)37-17-20(3)36(5)21(4)18-37/h7-16,20-21H,1,17-18H2,2-6H3,(H,33,39)(H,32,34,35)
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n/an/a 97n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234181
PNG
(CHEMBL4078914)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cc(NC(=O)C=C)cc(c3)C(F)(F)F)c2n1)N1CC(C)N(C)C(C)C1
Show InChI InChI=1S/C32H34F3N7O3/c1-7-28(43)37-22-11-21(32(33,34)35)12-24(13-22)42-29(44)10-18(2)25-15-36-31(39-30(25)42)38-26-9-8-23(14-27(26)45-6)41-16-19(3)40(5)20(4)17-41/h7-15,19-20H,1,16-17H2,2-6H3,(H,37,43)(H,36,38,39)
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n/an/a 97n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234182
PNG
(CHEMBL4064475)
Show SMILES CN1CCC(CC1)n1cc(Nc2ncc3c(C)cc(=O)n(-c4cccc(NC(=O)C=C)c4)c3n2)cn1
Show InChI InChI=1S/C26H28N8O2/c1-4-23(35)29-18-6-5-7-21(13-18)34-24(36)12-17(2)22-15-27-26(31-25(22)34)30-19-14-28-33(16-19)20-8-10-32(3)11-9-20/h4-7,12-16,20H,1,8-11H2,2-3H3,(H,29,35)(H,27,30,31)
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n/an/a 166n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234195
PNG
(CHEMBL4091276)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(NC(=O)C=C)c3)c2n1)N1CCN(C)C(C)C1
Show InChI InChI=1S/C30H33N7O3/c1-6-27(38)32-21-8-7-9-23(15-21)37-28(39)14-19(2)24-17-31-30(34-29(24)37)33-25-11-10-22(16-26(25)40-5)36-13-12-35(4)20(3)18-36/h6-11,14-17,20H,1,12-13,18H2,2-5H3,(H,32,38)(H,31,33,34)
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n/an/a 169n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234193
PNG
(CHEMBL4068047)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cc(NC(=O)C=C)cc(c3)C(F)(F)F)c2n1)N1CCN(C)CC1
Show InChI InChI=1S/C30H30F3N7O3/c1-5-26(41)35-20-13-19(30(31,32)33)14-22(15-20)40-27(42)12-18(2)23-17-34-29(37-28(23)40)36-24-7-6-21(16-25(24)43-4)39-10-8-38(3)9-11-39/h5-7,12-17H,1,8-11H2,2-4H3,(H,35,41)(H,34,36,37)
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n/an/a 182n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234189
PNG
(CHEMBL4078120)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cc(C)cc(NC(=O)C=C)c3)c2n1)N1CCN(C)CC1
Show InChI InChI=1S/C30H33N7O3/c1-6-27(38)32-21-13-19(2)14-23(16-21)37-28(39)15-20(3)24-18-31-30(34-29(24)37)33-25-8-7-22(17-26(25)40-5)36-11-9-35(4)10-12-36/h6-8,13-18H,1,9-12H2,2-5H3,(H,32,38)(H,31,33,34)
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n/an/a 208n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50029668
PNG
(AZD-9291 | Osimertinib | US10085983, Compound AZD-...)
Show SMILES COc1cc(N(C)CCN(C)C)c(NC(=O)C=C)cc1Nc1nccc(n1)-c1cn(C)c2ccccc12
Show InChI InChI=1S/C28H33N7O2/c1-7-27(36)30-22-16-23(26(37-6)17-25(22)34(4)15-14-33(2)3)32-28-29-13-12-21(31-28)20-18-35(5)24-11-9-8-10-19(20)24/h7-13,16-18H,1,14-15H2,2-6H3,(H,30,36)(H,29,31,32)
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n/an/a 260n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50131841
PNG
(CHEMBL3633143)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cccc(NC(=O)C=C)c3)c2n1)N1CCN(C)CC1
Show InChI InChI=1S/C29H31N7O3/c1-5-26(37)31-20-7-6-8-22(16-20)36-27(38)15-19(2)23-18-30-29(33-28(23)36)32-24-10-9-21(17-25(24)39-4)35-13-11-34(3)12-14-35/h5-10,15-18H,1,11-14H2,2-4H3,(H,31,37)(H,30,32,33)
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n/an/a 330n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM149404
PNG
(AVL-301 | CHEMBL3545308 | CNX-419 | CO-1686 | Roci...)
Show SMILES COc1cc(ccc1Nc1ncc(c(Nc2cccc(NC(=O)C=C)c2)n1)C(F)(F)F)N1CCN(CC1)C(C)=O
Show InChI InChI=1S/C27H28F3N7O3/c1-4-24(39)32-18-6-5-7-19(14-18)33-25-21(27(28,29)30)16-31-26(35-25)34-22-9-8-20(15-23(22)40-3)37-12-10-36(11-13-37)17(2)38/h4-9,14-16H,1,10-13H2,2-3H3,(H,32,39)(H2,31,33,34,35)
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n/an/a 344n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234194
PNG
(CHEMBL4082515)
Show SMILES CN(C)CCn1cc(Nc2ncc3c(C)cc(=O)n(-c4cccc(NC(=O)C=C)c4)c3n2)cn1
Show InChI InChI=1S/C24H26N8O2/c1-5-21(33)27-17-7-6-8-19(12-17)32-22(34)11-16(2)20-14-25-24(29-23(20)32)28-18-13-26-31(15-18)10-9-30(3)4/h5-8,11-15H,1,9-10H2,2-4H3,(H,27,33)(H,25,28,29)
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n/an/a 445n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234197
PNG
(CHEMBL4102389)
Show SMILES CCc1cc(NC(=O)C=C)cc(c1)-n1c2nc(Nc3ccc(cc3OC)N3CCN(C)CC3)ncc2c(C)cc1=O
Show InChI InChI=1S/C31H35N7O3/c1-6-21-15-22(33-28(39)7-2)17-24(16-21)38-29(40)14-20(3)25-19-32-31(35-30(25)38)34-26-9-8-23(18-27(26)41-5)37-12-10-36(4)11-13-37/h7-9,14-19H,2,6,10-13H2,1,3-5H3,(H,33,39)(H,32,34,35)
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n/an/a 472n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234184
PNG
(CHEMBL4063421)
Show SMILES CN1CCc2nc(Nc3ncc4c(C)cc(=O)n(-c5cccc(NC(=O)C=C)c5)c4n3)sc2C1
Show InChI InChI=1S/C24H23N7O2S/c1-4-20(32)26-15-6-5-7-16(11-15)31-21(33)10-14(2)17-12-25-23(28-22(17)31)29-24-27-18-8-9-30(3)13-19(18)34-24/h4-7,10-12H,1,8-9,13H2,2-3H3,(H,26,32)(H,25,27,28,29)
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n/an/a 550n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234191
PNG
(CHEMBL4097883)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(-c3cc(NC(=O)C=C)cc(c3)C(C)(C)C)c2n1)N1CCN(C)CC1
Show InChI InChI=1S/C33H39N7O3/c1-8-29(41)35-23-16-22(33(3,4)5)17-25(18-23)40-30(42)15-21(2)26-20-34-32(37-31(26)40)36-27-10-9-24(19-28(27)43-7)39-13-11-38(6)12-14-39/h8-10,15-20H,1,11-14H2,2-7H3,(H,35,41)(H,34,36,37)
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n/an/a>1.00E+3n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234192
PNG
(CHEMBL4073062)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n([C@@H]3CCN(C3)C(=O)C=C)c2n1)N1CCN(C)CC1 |r|
Show InChI InChI=1S/C27H33N7O3/c1-5-24(35)33-9-8-20(17-33)34-25(36)14-18(2)21-16-28-27(30-26(21)34)29-22-7-6-19(15-23(22)37-4)32-12-10-31(3)11-13-32/h5-7,14-16,20H,1,8-13,17H2,2-4H3,(H,28,29,30)/t20-/m1/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234186
PNG
(CHEMBL4099008)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(CC3CCN(C3)C(=O)C=C)c2n1)N1CCN(C)CC1
Show InChI InChI=1S/C28H35N7O3/c1-5-25(36)34-9-8-20(17-34)18-35-26(37)14-19(2)22-16-29-28(31-27(22)35)30-23-7-6-21(15-24(23)38-4)33-12-10-32(3)11-13-33/h5-7,14-16,20H,1,8-13,17-18H2,2-4H3,(H,29,30,31)
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n/an/a>1.00E+3n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234196
PNG
(CHEMBL4101484)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n(C3CCN(CC3)C(=O)C=C)c2n1)N1CCN(C)CC1
Show InChI InChI=1S/C28H35N7O3/c1-5-25(36)34-10-8-20(9-11-34)35-26(37)16-19(2)22-18-29-28(31-27(22)35)30-23-7-6-21(17-24(23)38-4)33-14-12-32(3)13-15-33/h5-7,16-18,20H,1,8-15H2,2-4H3,(H,29,30,31)
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n/an/a>1.00E+3n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50234187
PNG
(CHEMBL4093766)
Show SMILES COc1cc(ccc1Nc1ncc2c(C)cc(=O)n([C@H]3CCN(C3)C(=O)C=C)c2n1)N1CCN(C)CC1 |r|
Show InChI InChI=1S/C27H33N7O3/c1-5-24(35)33-9-8-20(17-33)34-25(36)14-18(2)21-16-28-27(30-26(21)34)29-22-7-6-19(15-23(22)37-4)32-12-10-31(3)11-13-32/h5-7,14-16,20H,1,8-13,17H2,2-4H3,(H,28,29,30)/t20-/m0/s1
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n/an/a>1.00E+3n/an/an/an/an/an/a



Guangzhou Institutes of Biomedicine and Health

Curated by ChEMBL


Assay Description
Inhibition of N-terminal 6His/TEV protease cleavage site-tagged wild type human EGFR using poly (Glu,Tyr) 4:1 as substrate after 1 hr by ELISA

Eur J Med Chem 126: 1107-1117 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.006
BindingDB Entry DOI: 10.7270/Q2F47RD5
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%