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54 similar compounds to monomer 31090

Wt: 509.9
BDBM50119074
Wt: 509.9
BDBM50122557
Wt: 495.9
BDBM50122558
Wt: 507.8
BDBM50122568
Wt: 453.8
BDBM50122574
Wt: 467.9
BDBM50122579
Wt: 495.9
BDBM50122585
Wt: 424.8
BDBM50122586
Wt: 467.9
BDBM50122587
Wt: 481.9
BDBM50122589
Wt: 556.0
BDBM50161877
Wt: 581.0
BDBM50161878
Wt: 590.5
BDBM50161879
Wt: 541.0
BDBM50161881
Wt: 570.0
BDBM50161886
Displayed 1 to 15 (of 54 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 49 hits for monomerid = 50119074,50122557,50122558,50122568,50122574,50122579,50122585,50122586,50122587,50122589,50161877,50161878,50161879,50161881,50161886   
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
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50161879
PNG
(4-Dimethylamino-but-2-enoic acid {4-[3-chloro-4-(3...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(Cl)c4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C31H29Cl2N5O3/c1-4-40-29-16-26-24(15-27(29)37-30(39)9-6-12-38(2)3)31(21(17-34)18-35-26)36-23-10-11-28(25(33)14-23)41-19-20-7-5-8-22(32)13-20/h5-11,13-16,18H,4,12,19H2,1-3H3,(H,35,36)(H,37,39)/b9-6+
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n/an/a 8n/an/an/an/an/an/a



University of Southern California

Curated by ChEMBL


Assay Description
Inhibition of HER2 (unknown origin)


J Med Chem 51: 3367-77 (2008)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122587
PNG
((E)-4-Dimethylamino-pent-2-enoic acid [4-(3-chloro...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\C(C)N(C)C
Show InChI InChI=1S/C24H23ClFN5O2/c1-14(31(2)3)5-8-23(32)30-21-10-17-20(11-22(21)33-4)28-13-15(12-27)24(17)29-16-6-7-19(26)18(25)9-16/h5-11,13-14H,1-4H3,(H,28,29)(H,30,32)/b8-5+
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n/an/a 5.25E+3n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition autophosphorylation of EGFR in human DiFi cells after 2 hrs by ELISA


Eur J Med Chem 43: 781-91 (2008)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50119074
PNG
(CHEMBL95774 | N-[4-(3-Chloro-4-fluoro-phenylamino)...)
Show SMILES Fc1ccc(Nc2c(cnc3cc(OCCCN4CCOCC4)c(NC(=O)C=C)cc23)C#N)cc1Cl
Show InChI InChI=1S/C26H25ClFN5O3/c1-2-25(34)32-23-13-19-22(14-24(23)36-9-3-6-33-7-10-35-11-8-33)30-16-17(15-29)26(19)31-18-4-5-21(28)20(27)12-18/h2,4-5,12-14,16H,1,3,6-11H2,(H,30,31)(H,32,34)
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n/an/a 80n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of Epidermal Growth Factor Receptor (EGFR) autophosphorylation


Citation and Details
More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122568
PNG
((E)-4-Dimethylamino-but-2-enoic acid [4-(3-chloro-...)
Show SMILES CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OC(F)(F)F)C#N
Show InChI InChI=1S/C23H18ClF4N5O2/c1-33(2)7-3-4-21(34)32-19-9-15-18(10-20(19)35-23(26,27)28)30-12-13(11-29)22(15)31-14-5-6-17(25)16(24)8-14/h3-6,8-10,12H,7H2,1-2H3,(H,30,31)(H,32,34)/b4-3+
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n/an/a 2.64E+3n/an/an/an/an/an/a



Georgetown University

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of epidermal growth factor receptor (EGFR)


Bioorg Med Chem Lett 14: 3397-400 (2004)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122558
PNG
((E)-4-Diethylamino-pent-2-enoic acid [4-(3-chloro-...)
Show SMILES CCN(CC)C(C)\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OC)C#N
Show InChI InChI=1S/C26H27ClFN5O2/c1-5-33(6-2)16(3)7-10-25(34)32-23-12-19-22(13-24(23)35-4)30-15-17(14-29)26(19)31-18-8-9-21(28)20(27)11-18/h7-13,15-16H,5-6H2,1-4H3,(H,30,31)(H,32,34)/b10-7+
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n/an/a 4.84E+3n/an/an/an/an/an/a



Georgetown University

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of epidermal growth factor receptor (EGFR)


Bioorg Med Chem Lett 14: 3397-400 (2004)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122579
PNG
(CHEMBL117326 | N-[4-(3-Chloro-4-fluoro-phenylamino...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)C(=C)CN(C)C
Show InChI InChI=1S/C24H23ClFN5O2/c1-5-33-22-10-20-17(9-21(22)30-24(32)14(2)13-31(3)4)23(15(11-27)12-28-20)29-16-6-7-19(26)18(25)8-16/h6-10,12H,2,5,13H2,1,3-4H3,(H,28,29)(H,30,32)
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n/an/a 560n/an/an/an/an/an/a



Georgetown University

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of epidermal growth factor receptor (EGFR)


Bioorg Med Chem Lett 14: 3397-400 (2004)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122587
PNG
((E)-4-Dimethylamino-pent-2-enoic acid [4-(3-chloro...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\C(C)N(C)C
Show InChI InChI=1S/C24H23ClFN5O2/c1-14(31(2)3)5-8-23(32)30-21-10-17-20(11-22(21)33-4)28-13-15(12-27)24(17)29-16-6-7-19(26)18(25)9-16/h5-11,13-14H,1-4H3,(H,28,29)(H,30,32)/b8-5+
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n/an/a 5.22E+3n/an/an/an/an/an/a



Georgetown University

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of epidermal growth factor receptor (EGFR)


Bioorg Med Chem Lett 14: 3397-400 (2004)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122586
PNG
((E)-But-2-enoic acid [4-(3-chloro-4-fluoro-phenyla...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\C
Show InChI InChI=1S/C22H18ClFN4O2/c1-3-5-21(29)28-19-9-15-18(10-20(19)30-4-2)26-12-13(11-25)22(15)27-14-6-7-17(24)16(23)8-14/h3,5-10,12H,4H2,1-2H3,(H,26,27)(H,28,29)/b5-3+
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n/an/a 7.50E+3n/an/an/an/an/an/a



Georgetown University

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of epidermal growth factor receptor (EGFR)


Bioorg Med Chem Lett 14: 3397-400 (2004)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122557
PNG
((E)-4-Morpholin-4-yl-pent-2-enoic acid [4-(3-chlor...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\C(C)N1CCOCC1
Show InChI InChI=1S/C26H25ClFN5O3/c1-16(33-7-9-36-10-8-33)3-6-25(34)32-23-12-19-22(13-24(23)35-2)30-15-17(14-29)26(19)31-18-4-5-21(28)20(27)11-18/h3-6,11-13,15-16H,7-10H2,1-2H3,(H,30,31)(H,32,34)/b6-3+
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n/an/a 1.06E+4n/an/an/an/an/an/a



Georgetown University

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of epidermal growth factor receptor (EGFR)


Bioorg Med Chem Lett 14: 3397-400 (2004)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122585
PNG
((E)-4-Morpholin-4-yl-but-2-enoic acid [4-(3-chloro...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN1CCOCC1
Show InChI InChI=1S/C25H23ClFN5O3/c1-34-23-13-21-18(12-22(23)31-24(33)3-2-6-32-7-9-35-10-8-32)25(16(14-28)15-29-21)30-17-4-5-20(27)19(26)11-17/h2-5,11-13,15H,6-10H2,1H3,(H,29,30)(H,31,33)/b3-2+
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n/an/a 1.36E+4n/an/an/an/an/an/a



Georgetown University

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of epidermal growth factor receptor (EGFR)


Bioorg Med Chem Lett 14: 3397-400 (2004)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122589
PNG
((E)-4-Diethylamino-but-2-enoic acid [4-(3-chloro-4...)
Show SMILES CCN(CC)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OC)C#N
Show InChI InChI=1S/C25H25ClFN5O2/c1-4-32(5-2)10-6-7-24(33)31-22-12-18-21(13-23(22)34-3)29-15-16(14-28)25(18)30-17-8-9-20(27)19(26)11-17/h6-9,11-13,15H,4-5,10H2,1-3H3,(H,29,30)(H,31,33)/b7-6+
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n/an/a 1.91E+3n/an/an/an/an/an/a



Georgetown University

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of epidermal growth factor receptor (EGFR)


Bioorg Med Chem Lett 14: 3397-400 (2004)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122574
PNG
((E)-4-Dimethylamino-but-2-enoic acid [4-(3-chloro-...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C23H21ClFN5O2/c1-30(2)8-4-5-22(31)29-20-10-16-19(11-21(20)32-3)27-13-14(12-26)23(16)28-15-6-7-18(25)17(24)9-15/h4-7,9-11,13H,8H2,1-3H3,(H,27,28)(H,29,31)/b5-4+
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n/an/a 2.32E+3n/an/an/an/an/an/a



Georgetown University

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of epidermal growth factor receptor (EGFR)


Bioorg Med Chem Lett 14: 3397-400 (2004)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50122574
PNG
((E)-4-Dimethylamino-but-2-enoic acid [4-(3-chloro-...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C23H21ClFN5O2/c1-30(2)8-4-5-22(31)29-20-10-16-19(11-21(20)32-3)27-13-14(12-26)23(16)28-15-6-7-18(25)17(24)9-15/h4-7,9-11,13H,8H2,1-3H3,(H,27,28)(H,29,31)/b5-4+
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n/an/a 4.49E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of human epidermal growth factor receptor-2


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122557
PNG
((E)-4-Morpholin-4-yl-pent-2-enoic acid [4-(3-chlor...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\C(C)N1CCOCC1
Show InChI InChI=1S/C26H25ClFN5O3/c1-16(33-7-9-36-10-8-33)3-6-25(34)32-23-12-19-22(13-24(23)35-2)30-15-17(14-29)26(19)31-18-4-5-21(28)20(27)11-18/h3-6,11-13,15-16H,7-10H2,1-2H3,(H,30,31)(H,32,34)/b6-3+
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n/an/a 1.06E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of autophosphorylation of cytoplasmic domain of epidermal growth factor receptor


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122586
PNG
((E)-But-2-enoic acid [4-(3-chloro-4-fluoro-phenyla...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\C
Show InChI InChI=1S/C22H18ClFN4O2/c1-3-5-21(29)28-19-9-15-18(10-20(19)30-4-2)26-12-13(11-25)22(15)27-14-6-7-17(24)16(23)8-14/h3,5-10,12H,4H2,1-2H3,(H,26,27)(H,28,29)/b5-3+
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n/an/a 7.50E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of autophosphorylation of cytoplasmic domain of epidermal growth factor receptor


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50122557
PNG
((E)-4-Morpholin-4-yl-pent-2-enoic acid [4-(3-chlor...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\C(C)N1CCOCC1
Show InChI InChI=1S/C26H25ClFN5O3/c1-16(33-7-9-36-10-8-33)3-6-25(34)32-23-12-19-22(13-24(23)35-2)30-15-17(14-29)26(19)31-18-4-5-21(28)20(27)11-18/h3-6,11-13,15-16H,7-10H2,1-2H3,(H,30,31)(H,32,34)/b6-3+
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n/an/a 3.40E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of human epidermal growth factor receptor-2


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50122585
PNG
((E)-4-Morpholin-4-yl-but-2-enoic acid [4-(3-chloro...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN1CCOCC1
Show InChI InChI=1S/C25H23ClFN5O3/c1-34-23-13-21-18(12-22(23)31-24(33)3-2-6-32-7-9-35-10-8-32)25(16(14-28)15-29-21)30-17-4-5-20(27)19(26)11-17/h2-5,11-13,15H,6-10H2,1H3,(H,29,30)(H,31,33)/b3-2+
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n/an/a 3.14E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of human epidermal growth factor receptor-2


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122568
PNG
((E)-4-Dimethylamino-but-2-enoic acid [4-(3-chloro-...)
Show SMILES CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OC(F)(F)F)C#N
Show InChI InChI=1S/C23H18ClF4N5O2/c1-33(2)7-3-4-21(34)32-19-9-15-18(10-20(19)35-23(26,27)28)30-12-13(11-29)22(15)31-14-5-6-17(25)16(24)8-14/h3-6,8-10,12H,7H2,1-2H3,(H,30,31)(H,32,34)/b4-3+
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n/an/a 2.64E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of autophosphorylation of cytoplasmic domain of epidermal growth factor receptor


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50122587
PNG
((E)-4-Dimethylamino-pent-2-enoic acid [4-(3-chloro...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\C(C)N(C)C
Show InChI InChI=1S/C24H23ClFN5O2/c1-14(31(2)3)5-8-23(32)30-21-10-17-20(11-22(21)33-4)28-13-15(12-27)24(17)29-16-6-7-19(26)18(25)9-16/h5-11,13-14H,1-4H3,(H,28,29)(H,30,32)/b8-5+
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n/an/a 1.18E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of human epidermal growth factor receptor-2


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50122579
PNG
(CHEMBL117326 | N-[4-(3-Chloro-4-fluoro-phenylamino...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)C(=C)CN(C)C
Show InChI InChI=1S/C24H23ClFN5O2/c1-5-33-22-10-20-17(9-21(22)30-24(32)14(2)13-31(3)4)23(15(11-27)12-28-20)29-16-6-7-19(26)18(25)8-16/h6-10,12H,2,5,13H2,1,3-4H3,(H,28,29)(H,30,32)
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n/an/a 1.21E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of human epidermal growth factor receptor-2


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122585
PNG
((E)-4-Morpholin-4-yl-but-2-enoic acid [4-(3-chloro...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN1CCOCC1
Show InChI InChI=1S/C25H23ClFN5O3/c1-34-23-13-21-18(12-22(23)31-24(33)3-2-6-32-7-9-35-10-8-32)25(16(14-28)15-29-21)30-17-4-5-20(27)19(26)11-17/h2-5,11-13,15H,6-10H2,1H3,(H,29,30)(H,31,33)/b3-2+
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n/an/a 1.36E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of autophosphorylation of cytoplasmic domain of epidermal growth factor receptor


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122574
PNG
((E)-4-Dimethylamino-but-2-enoic acid [4-(3-chloro-...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C23H21ClFN5O2/c1-30(2)8-4-5-22(31)29-20-10-16-19(11-21(20)32-3)27-13-14(12-26)23(16)28-15-6-7-18(25)17(24)9-15/h4-7,9-11,13H,8H2,1-3H3,(H,27,28)(H,29,31)/b5-4+
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n/an/a 2.32E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of autophosphorylation of cytoplasmic domain of epidermal growth factor receptor


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50122586
PNG
((E)-But-2-enoic acid [4-(3-chloro-4-fluoro-phenyla...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\C
Show InChI InChI=1S/C22H18ClFN4O2/c1-3-5-21(29)28-19-9-15-18(10-20(19)30-4-2)26-12-13(11-25)22(15)27-14-6-7-17(24)16(23)8-14/h3,5-10,12H,4H2,1-2H3,(H,26,27)(H,28,29)/b5-3+
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n/an/a 2.15E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of human epidermal growth factor receptor-2


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122579
PNG
(CHEMBL117326 | N-[4-(3-Chloro-4-fluoro-phenylamino...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)C(=C)CN(C)C
Show InChI InChI=1S/C24H23ClFN5O2/c1-5-33-22-10-20-17(9-21(22)30-24(32)14(2)13-31(3)4)23(15(11-27)12-28-20)29-16-6-7-19(26)18(25)8-16/h6-10,12H,2,5,13H2,1,3-4H3,(H,28,29)(H,30,32)
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n/an/a 560n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of autophosphorylation of cytoplasmic domain of epidermal growth factor receptor


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122587
PNG
((E)-4-Dimethylamino-pent-2-enoic acid [4-(3-chloro...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\C(C)N(C)C
Show InChI InChI=1S/C24H23ClFN5O2/c1-14(31(2)3)5-8-23(32)30-21-10-17-20(11-22(21)33-4)28-13-15(12-27)24(17)29-16-6-7-19(26)18(25)9-16/h5-11,13-14H,1-4H3,(H,28,29)(H,30,32)/b8-5+
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n/an/a 5.22E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of autophosphorylation of cytoplasmic domain of epidermal growth factor receptor


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50122558
PNG
((E)-4-Diethylamino-pent-2-enoic acid [4-(3-chloro-...)
Show SMILES CCN(CC)C(C)\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OC)C#N
Show InChI InChI=1S/C26H27ClFN5O2/c1-5-33(6-2)16(3)7-10-25(34)32-23-12-19-22(13-24(23)35-4)30-15-17(14-29)26(19)31-18-8-9-21(28)20(27)11-18/h7-13,15-16H,5-6H2,1-4H3,(H,30,31)(H,32,34)/b10-7+
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n/an/a 9.58E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of human epidermal growth factor receptor-2


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122589
PNG
((E)-4-Diethylamino-but-2-enoic acid [4-(3-chloro-4...)
Show SMILES CCN(CC)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OC)C#N
Show InChI InChI=1S/C25H25ClFN5O2/c1-4-32(5-2)10-6-7-24(33)31-22-12-18-21(13-23(22)34-3)29-15-16(14-28)25(18)30-17-8-9-20(27)19(26)11-17/h6-9,11-13,15H,4-5,10H2,1-3H3,(H,29,30)(H,31,33)/b7-6+
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n/an/a 1.91E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of autophosphorylation of cytoplasmic domain of epidermal growth factor receptor


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50122568
PNG
((E)-4-Dimethylamino-but-2-enoic acid [4-(3-chloro-...)
Show SMILES CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OC(F)(F)F)C#N
Show InChI InChI=1S/C23H18ClF4N5O2/c1-33(2)7-3-4-21(34)32-19-9-15-18(10-20(19)35-23(26,27)28)30-12-13(11-29)22(15)31-14-5-6-17(25)16(24)8-14/h3-6,8-10,12H,7H2,1-2H3,(H,30,31)(H,32,34)/b4-3+
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n/an/a 4.13E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of human epidermal growth factor receptor-2


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50122589
PNG
((E)-4-Diethylamino-but-2-enoic acid [4-(3-chloro-4...)
Show SMILES CCN(CC)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OC)C#N
Show InChI InChI=1S/C25H25ClFN5O2/c1-4-32(5-2)10-6-7-24(33)31-22-12-18-21(13-23(22)34-3)29-15-16(14-28)25(18)30-17-8-9-20(27)19(26)11-17/h6-9,11-13,15H,4-5,10H2,1-3H3,(H,29,30)(H,31,33)/b7-6+
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n/an/a 7.80E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Concentration required to inhibit autophosphorylation of cytoplasmic domain of human epidermal growth factor receptor-2


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122558
PNG
((E)-4-Diethylamino-pent-2-enoic acid [4-(3-chloro-...)
Show SMILES CCN(CC)C(C)\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OC)C#N
Show InChI InChI=1S/C26H27ClFN5O2/c1-5-33(6-2)16(3)7-10-25(34)32-23-12-19-22(13-24(23)35-4)30-15-17(14-29)26(19)31-18-8-9-21(28)20(27)11-18/h7-13,15-16H,5-6H2,1-4H3,(H,30,31)(H,32,34)/b10-7+
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n/an/a 4.84E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of autophosphorylation of cytoplasmic domain of epidermal growth factor receptor


J Med Chem 46: 49-63 (2002)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50161878
PNG
(4-Dimethylamino-but-2-enoic acid {4-[3-chloro-4-(3...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(c4)C#N)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C32H29ClN6O3/c1-4-41-30-16-27-25(15-28(30)38-31(40)9-6-12-39(2)3)32(23(18-35)19-36-27)37-24-10-11-29(26(33)14-24)42-20-22-8-5-7-21(13-22)17-34/h5-11,13-16,19H,4,12,20H2,1-3H3,(H,36,37)(H,38,40)/b9-6+
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n/an/a 161n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human epidermal growth factor receptor-2 (HER-2) autophosphorylation


J Med Chem 48: 1107-31 (2005)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50161879
PNG
(4-Dimethylamino-but-2-enoic acid {4-[3-chloro-4-(3...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(Cl)c4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C31H29Cl2N5O3/c1-4-40-29-16-26-24(15-27(29)37-30(39)9-6-12-38(2)3)31(21(17-34)18-35-26)36-23-10-11-28(25(33)14-23)41-19-20-7-5-8-22(32)13-20/h5-11,13-16,18H,4,12,19H2,1-3H3,(H,35,36)(H,37,39)/b9-6+
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n/an/a 7n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human epidermal growth factor receptor (EGFR) autophosphorylation


J Med Chem 48: 1107-31 (2005)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50161877
PNG
(4-Dimethylamino-but-2-enoic acid [4-(4-benzyloxy-3...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccc4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C31H30ClN5O3/c1-4-39-29-17-26-24(16-27(29)36-30(38)11-8-14-37(2)3)31(22(18-33)19-34-26)35-23-12-13-28(25(32)15-23)40-20-21-9-6-5-7-10-21/h5-13,15-17,19H,4,14,20H2,1-3H3,(H,34,35)(H,36,38)/b11-8+
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n/an/a 53n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human epidermal growth factor receptor (EGFR) autophosphorylation


J Med Chem 48: 1107-31 (2005)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50161879
PNG
(4-Dimethylamino-but-2-enoic acid {4-[3-chloro-4-(3...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(Cl)c4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C31H29Cl2N5O3/c1-4-40-29-16-26-24(15-27(29)37-30(39)9-6-12-38(2)3)31(21(17-34)18-35-26)36-23-10-11-28(25(33)14-23)41-19-20-7-5-8-22(32)13-20/h5-11,13-16,18H,4,12,19H2,1-3H3,(H,35,36)(H,37,39)/b9-6+
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n/an/a 8n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human epidermal growth factor receptor-2 (HER-2) autophosphorylation


J Med Chem 48: 1107-31 (2005)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50161886
PNG
(4-Dimethylamino-but-2-enoic acid {4-[3-chloro-4-(3...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(C)c4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C32H32ClN5O3/c1-5-40-30-17-27-25(16-28(30)37-31(39)10-7-13-38(3)4)32(23(18-34)19-35-27)36-24-11-12-29(26(33)15-24)41-20-22-9-6-8-21(2)14-22/h6-12,14-17,19H,5,13,20H2,1-4H3,(H,35,36)(H,37,39)/b10-7+
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n/an/a 132n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human epidermal growth factor receptor-2 (HER-2) autophosphorylation


J Med Chem 48: 1107-31 (2005)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50161877
PNG
(4-Dimethylamino-but-2-enoic acid [4-(4-benzyloxy-3...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4ccccc4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C31H30ClN5O3/c1-4-39-29-17-26-24(16-27(29)36-30(38)11-8-14-37(2)3)31(22(18-33)19-34-26)35-23-12-13-28(25(32)15-23)40-20-21-9-6-5-7-10-21/h5-13,15-17,19H,4,14,20H2,1-3H3,(H,34,35)(H,36,38)/b11-8+
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n/an/a 76n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human epidermal growth factor receptor-2 (HER-2) autophosphorylation


J Med Chem 48: 1107-31 (2005)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50161881
PNG
(4-Dimethylamino-but-2-enoic acid [4-(4-benzylamino...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(NCc4ccccc4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C30H29ClN6O2/c1-37(2)13-7-10-29(38)36-27-15-23-26(16-28(27)39-3)34-19-21(17-32)30(23)35-22-11-12-25(24(31)14-22)33-18-20-8-5-4-6-9-20/h4-12,14-16,19,33H,13,18H2,1-3H3,(H,34,35)(H,36,38)/b10-7+
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n/an/a 1.30E+4n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human epidermal growth factor receptor-2 (HER-2) autophosphorylation


J Med Chem 48: 1107-31 (2005)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50161878
PNG
(4-Dimethylamino-but-2-enoic acid {4-[3-chloro-4-(3...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(c4)C#N)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C32H29ClN6O3/c1-4-41-30-16-27-25(15-28(30)38-31(40)9-6-12-39(2)3)32(23(18-35)19-36-27)37-24-10-11-29(26(33)14-24)42-20-22-8-5-7-21(13-22)17-34/h5-11,13-16,19H,4,12,20H2,1-3H3,(H,36,37)(H,38,40)/b9-6+
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n/an/a 195n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human epidermal growth factor receptor (EGFR) autophosphorylation


J Med Chem 48: 1107-31 (2005)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50161886
PNG
(4-Dimethylamino-but-2-enoic acid {4-[3-chloro-4-(3...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(OCc4cccc(C)c4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C32H32ClN5O3/c1-5-40-30-17-27-25(16-28(30)37-31(39)10-7-13-38(3)4)32(23(18-34)19-35-27)36-24-11-12-29(26(33)15-24)41-20-22-9-6-8-21(2)14-22/h6-12,14-17,19H,5,13,20H2,1-4H3,(H,35,36)(H,37,39)/b10-7+
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n/an/a 111n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human epidermal growth factor receptor (EGFR) autophosphorylation


J Med Chem 48: 1107-31 (2005)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50161881
PNG
(4-Dimethylamino-but-2-enoic acid [4-(4-benzylamino...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(NCc4ccccc4)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C30H29ClN6O2/c1-37(2)13-7-10-29(38)36-27-15-23-26(16-28(27)39-3)34-19-21(17-32)30(23)35-22-11-12-25(24(31)14-22)33-18-20-8-5-4-6-9-20/h4-12,14-16,19,33H,13,18H2,1-3H3,(H,34,35)(H,36,38)/b10-7+
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n/an/a 400n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human epidermal growth factor receptor (EGFR) autophosphorylation


J Med Chem 48: 1107-31 (2005)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122574
PNG
((E)-4-Dimethylamino-but-2-enoic acid [4-(3-chloro-...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN(C)C
Show InChI InChI=1S/C23H21ClFN5O2/c1-30(2)8-4-5-22(31)29-20-10-16-19(11-21(20)32-3)27-13-14(12-26)23(16)28-15-6-7-18(25)17(24)9-15/h4-7,9-11,13H,8H2,1-3H3,(H,27,28)(H,29,31)/b5-4+
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n/an/a 2.34E+3n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition autophosphorylation of EGFR in human DiFi cells after 2 hrs by ELISA


Eur J Med Chem 43: 781-91 (2008)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122589
PNG
((E)-4-Diethylamino-but-2-enoic acid [4-(3-chloro-4...)
Show SMILES CCN(CC)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OC)C#N
Show InChI InChI=1S/C25H25ClFN5O2/c1-4-32(5-2)10-6-7-24(33)31-22-12-18-21(13-23(22)34-3)29-15-16(14-28)25(18)30-17-8-9-20(27)19(26)11-17/h6-9,11-13,15H,4-5,10H2,1-3H3,(H,29,30)(H,31,33)/b7-6+
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n/an/a 1.91E+3n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition autophosphorylation of EGFR in human DiFi cells after 2 hrs by ELISA


Eur J Med Chem 43: 781-91 (2008)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122585
PNG
((E)-4-Morpholin-4-yl-but-2-enoic acid [4-(3-chloro...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\CN1CCOCC1
Show InChI InChI=1S/C25H23ClFN5O3/c1-34-23-13-21-18(12-22(23)31-24(33)3-2-6-32-7-9-35-10-8-32)25(16(14-28)15-29-21)30-17-4-5-20(27)19(26)11-17/h2-5,11-13,15H,6-10H2,1H3,(H,29,30)(H,31,33)/b3-2+
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n/an/a 1.35E+4n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition autophosphorylation of EGFR in human DiFi cells after 2 hrs by ELISA


Eur J Med Chem 43: 781-91 (2008)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122558
PNG
((E)-4-Diethylamino-pent-2-enoic acid [4-(3-chloro-...)
Show SMILES CCN(CC)C(C)\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OC)C#N
Show InChI InChI=1S/C26H27ClFN5O2/c1-5-33(6-2)16(3)7-10-25(34)32-23-12-19-22(13-24(23)35-4)30-15-17(14-29)26(19)31-18-8-9-21(28)20(27)11-18/h7-13,15-16H,5-6H2,1-4H3,(H,30,31)(H,32,34)/b10-7+
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n/an/a 4.79E+3n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition autophosphorylation of EGFR in human DiFi cells after 2 hrs by ELISA


Eur J Med Chem 43: 781-91 (2008)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122557
PNG
((E)-4-Morpholin-4-yl-pent-2-enoic acid [4-(3-chlor...)
Show SMILES COc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\C(C)N1CCOCC1
Show InChI InChI=1S/C26H25ClFN5O3/c1-16(33-7-9-36-10-8-33)3-6-25(34)32-23-12-19-22(13-24(23)35-2)30-15-17(14-29)26(19)31-18-4-5-21(28)20(27)11-18/h3-6,11-13,15-16H,7-10H2,1-2H3,(H,30,31)(H,32,34)/b6-3+
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n/an/a 1.05E+4n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition autophosphorylation of EGFR in human DiFi cells after 2 hrs by ELISA


Eur J Med Chem 43: 781-91 (2008)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122586
PNG
((E)-But-2-enoic acid [4-(3-chloro-4-fluoro-phenyla...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)\C=C\C
Show InChI InChI=1S/C22H18ClFN4O2/c1-3-5-21(29)28-19-9-15-18(10-20(19)30-4-2)26-12-13(11-25)22(15)27-14-6-7-17(24)16(23)8-14/h3,5-10,12H,4H2,1-2H3,(H,26,27)(H,28,29)/b5-3+
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n/an/a 7.59E+3n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition autophosphorylation of EGFR in human DiFi cells after 2 hrs by ELISA


Eur J Med Chem 43: 781-91 (2008)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122579
PNG
(CHEMBL117326 | N-[4-(3-Chloro-4-fluoro-phenylamino...)
Show SMILES CCOc1cc2ncc(C#N)c(Nc3ccc(F)c(Cl)c3)c2cc1NC(=O)C(=C)CN(C)C
Show InChI InChI=1S/C24H23ClFN5O2/c1-5-33-22-10-20-17(9-21(22)30-24(32)14(2)13-31(3)4)23(15(11-27)12-28-20)29-16-6-7-19(26)18(25)8-16/h6-10,12H,2,5,13H2,1,3-4H3,(H,28,29)(H,30,32)
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n/an/a 562n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition autophosphorylation of EGFR in human DiFi cells after 2 hrs by ELISA


Eur J Med Chem 43: 781-91 (2008)

More data for this
Ligand-Target Pair
MER intracellular domain/EGFR extracellular domain chimera


(Homo sapiens (human))
BDBM50122568
PNG
((E)-4-Dimethylamino-but-2-enoic acid [4-(3-chloro-...)
Show SMILES CN(C)C\C=C\C(=O)Nc1cc2c(Nc3ccc(F)c(Cl)c3)c(cnc2cc1OC(F)(F)F)C#N
Show InChI InChI=1S/C23H18ClF4N5O2/c1-33(2)7-3-4-21(34)32-19-9-15-18(10-20(19)35-23(26,27)28)30-12-13(11-29)22(15)31-14-5-6-17(25)16(24)8-14/h3-6,8-10,12H,7H2,1-2H3,(H,30,31)(H,32,34)/b4-3+
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n/an/a 2.63E+3n/an/an/an/an/an/a



Korea Institute of Science and Technology

Curated by ChEMBL


Assay Description
Inhibition autophosphorylation of EGFR in human DiFi cells after 2 hrs by ELISA


Eur J Med Chem 43: 781-91 (2008)

More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (human))
BDBM50119074
PNG
(CHEMBL95774 | N-[4-(3-Chloro-4-fluoro-phenylamino)...)
Show SMILES Fc1ccc(Nc2c(cnc3cc(OCCCN4CCOCC4)c(NC(=O)C=C)cc23)C#N)cc1Cl
Show InChI InChI=1S/C26H25ClFN5O3/c1-2-25(34)32-23-13-19-22(14-24(23)36-9-3-6-33-7-10-35-11-8-33)30-16-17(15-29)26(19)31-18-4-5-21(28)20(27)12-18/h2,4-5,12-14,16H,1,3,6-11H2,(H,30,31)(H,32,34)
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n/an/a 1.69E+3n/an/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human epidermal growth factor receptor-2 autophosphorylation


Citation and Details
More data for this
Ligand-Target Pair