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Compile Data Set for Download or QSAR

Found 174 hits with Last Name = 'columbus' and Initial = 'j'   
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
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))		BDBM50236734
PNG
(CHEMBL4071886)
Show SMILES CN(c1cccc(c1)S(C)(=O)=O)c1ccc2[nH]nc(-c3ccncc3)c2c1
Show InChI InChI=1S/C20H18N4O2S/c1-24(15-4-3-5-17(12-15)27(2,25)26)16-6-7-19-18(13-16)20(23-22-19)14-8-10-21-11-9-14/h3-13H,1-2H3,(H,22,23)
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n/an/a 44n/an/an/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant LRRK2 expressed in baculovirus using fluorescein-ERM as substrate preincubated for 30 mins followed by subs...

J Med Chem 60: 2983-2992 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00045
BindingDB Entry DOI: 10.7270/Q2H997GZ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192487
PNG
((7,8-dimethoxy-10,11-dihydro-5H-2,4,5,11-tetraaza-...)
Show SMILES COc1cc2CNc3c(N[C@H](C)c4ccccc4)ncnc3Nc2cc1OC
Show InChI InChI=1S/C21H23N5O2/c1-13(14-7-5-4-6-8-14)25-20-19-21(24-12-23-20)26-16-10-18(28-3)17(27-2)9-15(16)11-22-19/h4-10,12-13,22H,11H2,1-3H3,(H2,23,24,25,26)/t13-/m1/s1
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n/an/a 150n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192474
PNG
(CHEMBL215191 | benzyl-(7,8-dimethoxy-10,11-dihydro...)
Show SMILES COc1cc2CNc3c(NCc4ccccc4)ncnc3Nc2cc1OC
Show InChI InChI=1S/C20H21N5O2/c1-26-16-8-14-11-21-18-19(22-10-13-6-4-3-5-7-13)23-12-24-20(18)25-15(14)9-17(16)27-2/h3-9,12,21H,10-11H2,1-2H3,(H2,22,23,24,25)
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n/an/a 200n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192498
PNG
((3-chloro-4-fluoro-benzyl)-(7,8-dimethoxy-10,11-di...)
Show SMILES COc1cc2CNc3c(NCc4ccc(F)c(Cl)c4)ncnc3Nc2cc1OC
Show InChI InChI=1S/C20H19ClFN5O2/c1-28-16-6-12-9-23-18-19(24-8-11-3-4-14(22)13(21)5-11)25-10-26-20(18)27-15(12)7-17(16)29-2/h3-7,10,23H,8-9H2,1-2H3,(H2,24,25,26,27)
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n/an/a 300n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180448
PNG
((3-Bromo-phenyl)-(7,8-dimethoxy-10,11-dihydro-5-ox...)
Show SMILES COc1cc2CNc3c(Nc4cccc(Br)c4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C19H17BrN4O3/c1-25-15-6-11-9-21-17-18(24-13-5-3-4-12(20)7-13)22-10-23-19(17)27-14(11)8-16(15)26-2/h3-8,10,21H,9H2,1-2H3,(H,22,23,24)
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n/an/a 300n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192477
PNG
((3-chloro-2-fluoro-phenyl)-(7,8-dimethoxy-10,11-di...)
Show SMILES COc1cc2CNc3c(Nc4cccc(Cl)c4F)ncnc3Oc2cc1OC
Show InChI InChI=1S/C19H16ClFN4O3/c1-26-14-6-10-8-22-17-18(25-12-5-3-4-11(20)16(12)21)23-9-24-19(17)28-13(10)7-15(14)27-2/h3-7,9,22H,8H2,1-2H3,(H,23,24,25)
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ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))		BDBM50174697
PNG
(3-fluoro-N-[5-(7-methoxy-10,11-dihydro-5-oxa-2,4,1...)
Show SMILES COc1ccc2CNc3c(Nc4cnc(NC(=O)c5cccc(F)c5)nc4)ncnc3Oc2c1
Show InChI InChI=1S/C23H18FN7O3/c1-33-17-6-5-14-9-25-19-20(28-12-29-22(19)34-18(14)8-17)30-16-10-26-23(27-11-16)31-21(32)13-3-2-4-15(24)7-13/h2-8,10-12,25H,9H2,1H3,(H,28,29,30)(H,26,27,31,32)
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n/an/a 320n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against Aurora A kinase

Bioorg Med Chem Lett 15: 5474-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.098
BindingDB Entry DOI: 10.7270/Q2S46RGS
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))		BDBM50174698
PNG
(4-fluoro-N-[5-(7-methoxy-10,11-dihydro-5-oxa-2,4,1...)
Show SMILES COc1ccc2CNc3c(Nc4cnc(NC(=O)c5ccc(F)cc5)nc4)ncnc3Oc2c1
Show InChI InChI=1S/C23H18FN7O3/c1-33-17-7-4-14-9-25-19-20(28-12-29-22(19)34-18(14)8-17)30-16-10-26-23(27-11-16)31-21(32)13-2-5-15(24)6-3-13/h2-8,10-12,25H,9H2,1H3,(H,28,29,30)(H,26,27,31,32)
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n/an/a 330n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against Aurora A kinase

Bioorg Med Chem Lett 15: 5474-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.098
BindingDB Entry DOI: 10.7270/Q2S46RGS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180448
PNG
((3-Bromo-phenyl)-(7,8-dimethoxy-10,11-dihydro-5-ox...)
Show SMILES COc1cc2CNc3c(Nc4cccc(Br)c4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C19H17BrN4O3/c1-25-15-6-11-9-21-17-18(24-13-5-3-4-12(20)7-13)22-10-23-19(17)27-14(11)8-16(15)26-2/h3-8,10,21H,9H2,1-2H3,(H,22,23,24)
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n/an/a 340n/an/an/an/an/an/a



ImClone Systems

Curated by ChEMBL


Assay Description
Inhibition of EGFR

Bioorg Med Chem Lett 16: 1643-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.018
BindingDB Entry DOI: 10.7270/Q2XP74JC
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))		BDBM50174686
PNG
(1-(1-chloro-5-oxa-2,4,11-triaza-dibenzo[a,d]cycloh...)
Show SMILES FC(F)(F)c1cc(NC(=O)Nc2ccc3Oc4ncnc(Cl)c4N=Cc3c2)ccc1Cl |c:24|
Show InChI InChI=1S/C19H10Cl2F3N5O2/c20-13-3-1-11(6-12(13)19(22,23)24)29-18(30)28-10-2-4-14-9(5-10)7-25-15-16(21)26-8-27-17(15)31-14/h1-8H,(H2,28,29,30)
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n/an/a 450n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against FLT3 kinase in a HTRF assay

Bioorg Med Chem Lett 15: 5474-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.098
BindingDB Entry DOI: 10.7270/Q2S46RGS
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))		BDBM50174689
PNG
(CHEMBL439512 | N-[5-(7,8-dimethoxy-10,11-dihydro-5...)
Show SMILES COc1cc2CNc3c(Nc4cnc(NC(=O)c5ccccc5)nc4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C24H21N7O4/c1-33-18-8-15-10-25-20-21(28-13-29-23(20)35-17(15)9-19(18)34-2)30-16-11-26-24(27-12-16)31-22(32)14-6-4-3-5-7-14/h3-9,11-13,25H,10H2,1-2H3,(H,28,29,30)(H,26,27,31,32)
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n/an/a 470n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against Aurora A kinase

Bioorg Med Chem Lett 15: 5474-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.098
BindingDB Entry DOI: 10.7270/Q2S46RGS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180448
PNG
((3-Bromo-phenyl)-(7,8-dimethoxy-10,11-dihydro-5-ox...)
Show SMILES COc1cc2CNc3c(Nc4cccc(Br)c4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C19H17BrN4O3/c1-25-15-6-11-9-21-17-18(24-13-5-3-4-12(20)7-13)22-10-23-19(17)27-14(11)8-16(15)26-2/h3-8,10,21H,9H2,1-2H3,(H,22,23,24)
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n/an/a 470n/an/an/an/an/an/a



ImClone Systems

Curated by ChEMBL


Assay Description
Inhibition of EGFR autophosphorylation in DiFi cells

Bioorg Med Chem Lett 16: 1643-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.018
BindingDB Entry DOI: 10.7270/Q2XP74JC
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180448
PNG
((3-Bromo-phenyl)-(7,8-dimethoxy-10,11-dihydro-5-ox...)
Show SMILES COc1cc2CNc3c(Nc4cccc(Br)c4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C19H17BrN4O3/c1-25-15-6-11-9-21-17-18(24-13-5-3-4-12(20)7-13)22-10-23-19(17)27-14(11)8-16(15)26-2/h3-8,10,21H,9H2,1-2H3,(H,22,23,24)
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ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR autophosphorylation in DiFi cells by ELISA

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192487
PNG
((7,8-dimethoxy-10,11-dihydro-5H-2,4,5,11-tetraaza-...)
Show SMILES COc1cc2CNc3c(N[C@H](C)c4ccccc4)ncnc3Nc2cc1OC
Show InChI InChI=1S/C21H23N5O2/c1-13(14-7-5-4-6-8-14)25-20-19-21(24-12-23-20)26-16-10-18(28-3)17(27-2)9-15(16)11-22-19/h4-10,12-13,22H,11H2,1-3H3,(H2,23,24,25,26)/t13-/m1/s1
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ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR autophosphorylation in DiFi cells by ELISA

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192471
PNG
((7,8-dimethoxy-10,11-dihydro-5-oxa-2,4,11-triaza-d...)
Show SMILES COc1cc2CNc3c(Nc4ccc5ccccc5c4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C23H20N4O3/c1-28-19-10-16-12-24-21-22(25-13-26-23(21)30-18(16)11-20(19)29-2)27-17-8-7-14-5-3-4-6-15(14)9-17/h3-11,13,24H,12H2,1-2H3,(H,25,26,27)
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ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))		BDBM50174692
PNG
(CHEMBL200525 | N-[5-(7-methoxy-10,11-dihydro-5-oxa...)
Show SMILES COc1ccc2CNc3c(Nc4cnc(NC(=O)c5ccccc5)nc4)ncnc3Oc2c1
Show InChI InChI=1S/C23H19N7O3/c1-32-17-8-7-15-10-24-19-20(27-13-28-22(19)33-18(15)9-17)29-16-11-25-23(26-12-16)30-21(31)14-5-3-2-4-6-14/h2-9,11-13,24H,10H2,1H3,(H,27,28,29)(H,25,26,30,31)
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n/an/a 600n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against Aurora A kinase

Bioorg Med Chem Lett 15: 5474-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.098
BindingDB Entry DOI: 10.7270/Q2S46RGS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180453
PNG
((3-Chloro-4-fluoro-phenyl)-(7,8-dimethoxy-10,11-di...)
Show SMILES COc1cc2CNc3c(Nc4ccc(F)c(Cl)c4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C19H16ClFN4O3/c1-26-15-5-10-8-22-17-18(25-11-3-4-13(21)12(20)6-11)23-9-24-19(17)28-14(10)7-16(15)27-2/h3-7,9,22H,8H2,1-2H3,(H,23,24,25)
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n/an/a 690n/an/an/an/an/an/a



ImClone Systems

Curated by ChEMBL


Assay Description
Inhibition of EGFR autophosphorylation in DiFi cells

Bioorg Med Chem Lett 16: 1643-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.018
BindingDB Entry DOI: 10.7270/Q2XP74JC
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180453
PNG
((3-Chloro-4-fluoro-phenyl)-(7,8-dimethoxy-10,11-di...)
Show SMILES COc1cc2CNc3c(Nc4ccc(F)c(Cl)c4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C19H16ClFN4O3/c1-26-15-5-10-8-22-17-18(25-11-3-4-13(21)12(20)6-11)23-9-24-19(17)28-14(10)7-16(15)27-2/h3-7,9,22H,8H2,1-2H3,(H,23,24,25)
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n/an/a 700n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR autophosphorylation in DiFi cells by ELISA

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192478
PNG
(1-(3-bromo-phenoxy)-7,8-dimethoxy-10,11-dihydro-5-...)
Show SMILES COc1cc2CNc3c(Oc4cccc(Br)c4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C19H16BrN3O4/c1-24-15-6-11-9-21-17-18(26-13-5-3-4-12(20)7-13)22-10-23-19(17)27-14(11)8-16(15)25-2/h3-8,10,21H,9H2,1-2H3
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n/an/a 700n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Leucine-rich repeat serine/threonine-protein kinase 2


(Homo sapiens (Human))		BDBM50236735
PNG
(CHEMBL4060479)
Show SMILES Nc1cc(ccn1)-c1n[nH]c2ccc(Nc3ccccc3)cc12
Show InChI InChI=1S/C18H15N5/c19-17-10-12(8-9-20-17)18-15-11-14(6-7-16(15)22-23-18)21-13-4-2-1-3-5-13/h1-11,21H,(H2,19,20)(H,22,23)
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n/an/a 728n/an/an/an/an/an/a



Merck& Co.

Curated by ChEMBL


Assay Description
Inhibition of wild type human recombinant LRRK2 expressed in baculovirus using fluorescein-ERM as substrate preincubated for 30 mins followed by subs...

J Med Chem 60: 2983-2992 (2017)


Article DOI: 10.1021/acs.jmedchem.7b00045
BindingDB Entry DOI: 10.7270/Q2H997GZ
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192497
PNG
((7,8-dimethoxy-10,11-dihydro-5H-2,4,5,11-tetraaza-...)
Show SMILES COc1cccc(CNc2ncnc3Nc4cc(OC)c(OC)cc4CNc23)c1
Show InChI InChI=1S/C21H23N5O3/c1-27-15-6-4-5-13(7-15)10-23-20-19-21(25-12-24-20)26-16-9-18(29-3)17(28-2)8-14(16)11-22-19/h4-9,12,22H,10-11H2,1-3H3,(H2,23,24,25,26)
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n/an/a 800n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192474
PNG
(CHEMBL215191 | benzyl-(7,8-dimethoxy-10,11-dihydro...)
Show SMILES COc1cc2CNc3c(NCc4ccccc4)ncnc3Nc2cc1OC
Show InChI InChI=1S/C20H21N5O2/c1-26-16-8-14-11-21-18-19(22-10-13-6-4-3-5-7-13)23-12-24-20(18)25-15(14)9-17(16)27-2/h3-9,12,21H,10-11H2,1-2H3,(H2,22,23,24,25)
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n/an/a 900n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR autophosphorylation in DiFi cells by ELISA

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180443
PNG
((3-Chloro-4-fluoro-phenyl)-(8-methoxy-10,11-dihydr...)
Show SMILES COc1ccc2Oc3ncnc(Nc4ccc(F)c(Cl)c4)c3NCc2c1
Show InChI InChI=1S/C18H14ClFN4O2/c1-25-12-3-5-15-10(6-12)8-21-16-17(22-9-23-18(16)26-15)24-11-2-4-14(20)13(19)7-11/h2-7,9,21H,8H2,1H3,(H,22,23,24)
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n/an/a 900n/an/an/an/an/an/a



ImClone Systems

Curated by ChEMBL


Assay Description
Inhibition of EGFR

Bioorg Med Chem Lett 16: 1643-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.018
BindingDB Entry DOI: 10.7270/Q2XP74JC
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192501
PNG
((7,8-dimethoxy-10,11-dihydro-5-oxa-2,4,11-triaza-d...)
Show SMILES COc1cc2CNc3c(Nc4cccc(c4)C#C)ncnc3Oc2cc1OC
Show InChI InChI=1S/C21H18N4O3/c1-4-13-6-5-7-15(8-13)25-20-19-21(24-12-23-20)28-16-10-18(27-3)17(26-2)9-14(16)11-22-19/h1,5-10,12,22H,11H2,2-3H3,(H,23,24,25)
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n/an/a 900n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR autophosphorylation in DiFi cells by ELISA

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3


(Homo sapiens (Human))		BDBM50174701
PNG
(1-(3-chloro-10,11-dihydro-5-oxa-2,4,11-triaza-dibe...)
Show SMILES FC(F)(F)c1cc(NC(=O)Nc2ccc3Oc4nc(Cl)ncc4NCc3c2)ccc1Cl
Show InChI InChI=1S/C19H12Cl2F3N5O2/c20-13-3-1-11(6-12(13)19(22,23)24)28-18(30)27-10-2-4-15-9(5-10)7-25-14-8-26-17(21)29-16(14)31-15/h1-6,8,25H,7H2,(H2,27,28,30)
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n/an/a 900n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against FLT3 kinase in a HTRF assay

Bioorg Med Chem Lett 15: 5474-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.098
BindingDB Entry DOI: 10.7270/Q2S46RGS
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))		BDBM50174690
PNG
(CHEMBL199547 | N-[5-(8-methoxy-10,11-dihydro-5-oxa...)
Show SMILES COc1ccc2Oc3ncnc(Nc4cnc(NC(=O)c5ccccc5)nc4)c3NCc2c1
Show InChI InChI=1S/C23H19N7O3/c1-32-17-7-8-18-15(9-17)10-24-19-20(27-13-28-22(19)33-18)29-16-11-25-23(26-12-16)30-21(31)14-5-3-2-4-6-14/h2-9,11-13,24H,10H2,1H3,(H,27,28,29)(H,25,26,30,31)
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n/an/a 970n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against Aurora A kinase

Bioorg Med Chem Lett 15: 5474-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.098
BindingDB Entry DOI: 10.7270/Q2S46RGS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180447
PNG
((3-Chloro-4-fluoro-phenyl)-(7-methoxy-10,11-dihydr...)
Show SMILES COc1ccc2CNc3c(Nc4ccc(F)c(Cl)c4)ncnc3Oc2c1
Show InChI InChI=1S/C18H14ClFN4O2/c1-25-12-4-2-10-8-21-16-17(22-9-23-18(16)26-15(10)7-12)24-11-3-5-14(20)13(19)6-11/h2-7,9,21H,8H2,1H3,(H,22,23,24)
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n/an/a 1.00E+3n/an/an/an/an/an/a



ImClone Systems

Curated by ChEMBL


Assay Description
Inhibition of EGFR

Bioorg Med Chem Lett 16: 1643-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.018
BindingDB Entry DOI: 10.7270/Q2XP74JC
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180440
PNG
(1-(3-Bromo-phenylamino)-10,11-dihydro-5-oxa-2,4,11...)
Show SMILES OC(=O)c1ccc2Oc3ncnc(Nc4cccc(Br)c4)c3NCc2c1
Show InChI InChI=1S/C18H13BrN4O3/c19-12-2-1-3-13(7-12)23-16-15-17(22-9-21-16)26-14-5-4-10(18(24)25)6-11(14)8-20-15/h1-7,9,20H,8H2,(H,24,25)(H,21,22,23)
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n/an/a 1.00E+3n/an/an/an/an/an/a



ImClone Systems

Curated by ChEMBL


Assay Description
Inhibition of EGFR

Bioorg Med Chem Lett 16: 1643-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.018
BindingDB Entry DOI: 10.7270/Q2XP74JC
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180424
PNG
((3-Chloro-4-fluoro-phenyl)-(8-fluoro-10,11-dihydro...)
Show SMILES Fc1ccc2Oc3ncnc(Nc4ccc(F)c(Cl)c4)c3NCc2c1
Show InChI InChI=1S/C17H11ClF2N4O/c18-12-6-11(2-3-13(12)20)24-16-15-17(23-8-22-16)25-14-4-1-10(19)5-9(14)7-21-15/h1-6,8,21H,7H2,(H,22,23,24)
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n/an/a 1.00E+3n/an/an/an/an/an/a



ImClone Systems

Curated by ChEMBL


Assay Description
Inhibition of EGFR

Bioorg Med Chem Lett 16: 1643-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.018
BindingDB Entry DOI: 10.7270/Q2XP74JC
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180438
PNG
((8-Bromo-10,11-dihydro-5-oxa-2,4,11-triaza-dibenzo...)
Show SMILES Brc1cccc(Nc2ncnc3Oc4ccc(Br)cc4CNc23)c1
Show InChI InChI=1S/C17H12Br2N4O/c18-11-2-1-3-13(7-11)23-16-15-17(22-9-21-16)24-14-5-4-12(19)6-10(14)8-20-15/h1-7,9,20H,8H2,(H,21,22,23)
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n/an/a 1.00E+3n/an/an/an/an/an/a



ImClone Systems

Curated by ChEMBL


Assay Description
Inhibition of EGFR

Bioorg Med Chem Lett 16: 1643-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.018
BindingDB Entry DOI: 10.7270/Q2XP74JC
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180432
PNG
((8-Chloro-10,11-dihydro-5-oxa-2,4,11-triaza-dibenz...)
Show SMILES Fc1ccc(Nc2ncnc3Oc4ccc(Cl)cc4CNc23)cc1Cl
Show InChI InChI=1S/C17H11Cl2FN4O/c18-10-1-4-14-9(5-10)7-21-15-16(22-8-23-17(15)25-14)24-11-2-3-13(20)12(19)6-11/h1-6,8,21H,7H2,(H,22,23,24)
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n/an/a 1.00E+3n/an/an/an/an/an/a



ImClone Systems

Curated by ChEMBL


Assay Description
Inhibition of EGFR

Bioorg Med Chem Lett 16: 1643-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.018
BindingDB Entry DOI: 10.7270/Q2XP74JC
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180433
PNG
((3-Bromo-phenyl)-(8-methoxy-10,11-dihydro-5-oxa-2,...)
Show SMILES COc1ccc2Oc3ncnc(Nc4cccc(Br)c4)c3NCc2c1
Show InChI InChI=1S/C18H15BrN4O2/c1-24-14-5-6-15-11(7-14)9-20-16-17(21-10-22-18(16)25-15)23-13-4-2-3-12(19)8-13/h2-8,10,20H,9H2,1H3,(H,21,22,23)
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n/an/a 1.00E+3n/an/an/an/an/an/a



ImClone Systems

Curated by ChEMBL


Assay Description
Inhibition of EGFR autophosphorylation in DiFi cells

Bioorg Med Chem Lett 16: 1643-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.018
BindingDB Entry DOI: 10.7270/Q2XP74JC
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192496
PNG
(1-(3-chloro-phenylsulfanyl)-7,8-dimethoxy-10,11-di...)
Show SMILES COc1cc2CNc3c(Oc2cc1OC)ncnc3Sc1cccc(Cl)c1
Show InChI InChI=1S/C19H16ClN3O3S/c1-24-15-6-11-9-21-17-18(26-14(11)8-16(15)25-2)22-10-23-19(17)27-13-5-3-4-12(20)7-13/h3-8,10,21H,9H2,1-2H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))		BDBM50174694
PNG
(CHEMBL371937 | N-[5-(7,8-dimethoxy-10,11-dihydro-5...)
Show SMILES COc1cc2CNc3c(Nc4cnc(NC(=O)c5cccc(F)c5)nc4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C24H20FN7O4/c1-34-18-7-14-9-26-20-21(29-12-30-23(20)36-17(14)8-19(18)35-2)31-16-10-27-24(28-11-16)32-22(33)13-4-3-5-15(25)6-13/h3-8,10-12,26H,9H2,1-2H3,(H,29,30,31)(H,27,28,32,33)
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n/an/a 1.10E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against Aurora A kinase

Bioorg Med Chem Lett 15: 5474-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.098
BindingDB Entry DOI: 10.7270/Q2S46RGS
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))		BDBM50174691
PNG
(3-fluoro-N-[5-(8-methoxy-10,11-dihydro-5-oxa-2,4,1...)
Show SMILES COc1ccc2Oc3ncnc(Nc4cnc(NC(=O)c5cccc(F)c5)nc4)c3NCc2c1
Show InChI InChI=1S/C23H18FN7O3/c1-33-17-5-6-18-14(8-17)9-25-19-20(28-12-29-22(19)34-18)30-16-10-26-23(27-11-16)31-21(32)13-3-2-4-15(24)7-13/h2-8,10-12,25H,9H2,1H3,(H,28,29,30)(H,26,27,31,32)
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n/an/a 1.10E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against Aurora A kinase

Bioorg Med Chem Lett 15: 5474-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.098
BindingDB Entry DOI: 10.7270/Q2S46RGS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180441
PNG
((3-Chloro-4-fluoro-phenyl)-(10,11-dihydro-5-oxa-2,...)
Show SMILES Fc1ccc(Nc2ncnc3Oc4ccccc4CNc23)cc1Cl
Show InChI InChI=1S/C17H12ClFN4O/c18-12-7-11(5-6-13(12)19)23-16-15-17(22-9-21-16)24-14-4-2-1-3-10(14)8-20-15/h1-7,9,20H,8H2,(H,21,22,23)
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n/an/a 1.10E+3n/an/an/an/an/an/a



ImClone Systems

Curated by ChEMBL


Assay Description
Inhibition of EGFR

Bioorg Med Chem Lett 16: 1643-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.018
BindingDB Entry DOI: 10.7270/Q2XP74JC
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192479
PNG
((5-chloro-2-fluoro-phenyl)-(7,8-dimethoxy-10,11-di...)
Show SMILES COc1cc2CNc3c(Nc4cc(Cl)ccc4F)ncnc3Oc2cc1OC
Show InChI InChI=1S/C19H16ClFN4O3/c1-26-15-5-10-8-22-17-18(25-13-6-11(20)3-4-12(13)21)23-9-24-19(17)28-14(10)7-16(15)27-2/h3-7,9,22H,8H2,1-2H3,(H,23,24,25)
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n/an/a 1.10E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180453
PNG
((3-Chloro-4-fluoro-phenyl)-(7,8-dimethoxy-10,11-di...)
Show SMILES COc1cc2CNc3c(Nc4ccc(F)c(Cl)c4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C19H16ClFN4O3/c1-26-15-5-10-8-22-17-18(25-11-3-4-13(21)12(20)6-11)23-9-24-19(17)28-14(10)7-16(15)27-2/h3-7,9,22H,8H2,1-2H3,(H,23,24,25)
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n/an/a 1.20E+3n/an/an/an/an/an/a



ImClone Systems

Curated by ChEMBL


Assay Description
Inhibition of EGFR

Bioorg Med Chem Lett 16: 1643-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.018
BindingDB Entry DOI: 10.7270/Q2XP74JC
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192489
PNG
(1-(3-bromo-phenylsulfanyl)-7,8-dimethoxy-10,11-dih...)
Show SMILES COc1cc2CNc3c(Oc2cc1OC)ncnc3Sc1cccc(Br)c1
Show InChI InChI=1S/C19H16BrN3O3S/c1-24-15-6-11-9-21-17-18(26-14(11)8-16(15)25-2)22-10-23-19(17)27-13-5-3-4-12(20)7-13/h3-8,10,21H,9H2,1-2H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR autophosphorylation in DiFi cells by ELISA

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192480
PNG
((7,8-dimethoxy-10,11-dihydro-5-oxa-2,4,11-triaza-d...)
Show SMILES COc1cc2CNc3c(Nc4ccc5c[nH]nc5c4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C20H18N6O3/c1-27-16-5-12-8-21-18-19(25-13-4-3-11-9-24-26-14(11)6-13)22-10-23-20(18)29-15(12)7-17(16)28-2/h3-7,9-10,21H,8H2,1-2H3,(H,24,26)(H,22,23,25)
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n/an/a 1.20E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192473
PNG
(7-(3-bromophenoxy)-13,14-dimethoxy-9-methyl-2-oxa-...)
Show SMILES COc1cc2CN(C)c3c(Oc4cccc(Br)c4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C20H18BrN3O4/c1-24-10-12-7-16(25-2)17(26-3)9-15(12)28-20-18(24)19(22-11-23-20)27-14-6-4-5-13(21)8-14/h4-9,11H,10H2,1-3H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))		BDBM50174700
PNG
(CHEMBL199950 | N-[5-(7,8-dimethoxy-10,11-dihydro-5...)
Show SMILES COc1cc2CNc3c(Nc4cnc(NC(=O)c5ccc(C)cc5)nc4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C25H23N7O4/c1-14-4-6-15(7-5-14)23(33)32-25-27-11-17(12-28-25)31-22-21-24(30-13-29-22)36-18-9-20(35-3)19(34-2)8-16(18)10-26-21/h4-9,11-13,26H,10H2,1-3H3,(H,29,30,31)(H,27,28,32,33)
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n/an/a 1.20E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibitory activity against Aurora A kinase

Bioorg Med Chem Lett 15: 5474-7 (2005)


Article DOI: 10.1016/j.bmcl.2005.08.098
BindingDB Entry DOI: 10.7270/Q2S46RGS
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180453
PNG
((3-Chloro-4-fluoro-phenyl)-(7,8-dimethoxy-10,11-di...)
Show SMILES COc1cc2CNc3c(Nc4ccc(F)c(Cl)c4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C19H16ClFN4O3/c1-26-15-5-10-8-22-17-18(25-11-3-4-13(21)12(20)6-11)23-9-24-19(17)28-14(10)7-16(15)27-2/h3-7,9,22H,8H2,1-2H3,(H,23,24,25)
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n/an/a 1.20E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192489
PNG
(1-(3-bromo-phenylsulfanyl)-7,8-dimethoxy-10,11-dih...)
Show SMILES COc1cc2CNc3c(Oc2cc1OC)ncnc3Sc1cccc(Br)c1
Show InChI InChI=1S/C19H16BrN3O3S/c1-24-15-6-11-9-21-17-18(26-14(11)8-16(15)25-2)22-10-23-19(17)27-13-5-3-4-12(20)7-13/h3-8,10,21H,9H2,1-2H3
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n/an/a 1.30E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192500
PNG
((3-bromo-phenyl)-(7,8-dimethoxy-10,11-dihydro-5H-2...)
Show SMILES COc1cc2CNc3c(Nc4cccc(Br)c4)ncnc3Nc2cc1OC
Show InChI InChI=1S/C19H18BrN5O2/c1-26-15-6-11-9-21-17-18(24-13-5-3-4-12(20)7-13)22-10-23-19(17)25-14(11)8-16(15)27-2/h3-8,10,21H,9H2,1-2H3,(H2,22,23,24,25)
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n/an/a 1.50E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180426
PNG
((3-Bromo-phenyl)-(8-fluoro-10,11-dihydro-5-oxa-2,4...)
Show SMILES Fc1ccc2Oc3ncnc(Nc4cccc(Br)c4)c3NCc2c1
Show InChI InChI=1S/C17H12BrFN4O/c18-11-2-1-3-13(7-11)23-16-15-17(22-9-21-16)24-14-5-4-12(19)6-10(14)8-20-15/h1-7,9,20H,8H2,(H,21,22,23)
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n/an/a 1.50E+3n/an/an/an/an/an/a



ImClone Systems

Curated by ChEMBL


Assay Description
Inhibition of EGFR

Bioorg Med Chem Lett 16: 1643-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.018
BindingDB Entry DOI: 10.7270/Q2XP74JC
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192483
PNG
(1-(3-bromo-phenylsulfanyl)-7,8-dimethoxy-10,11-dih...)
Show SMILES COc1cc2CNc3c(Sc4cccc(Br)c4)ncnc3Sc2cc1OC
Show InChI InChI=1S/C19H16BrN3O2S2/c1-24-14-6-11-9-21-17-18(26-13-5-3-4-12(20)7-13)22-10-23-19(17)27-16(11)8-15(14)25-2/h3-8,10,21H,9H2,1-2H3
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n/an/a 1.60E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR measured as pGAT-biotin peptide phosphorylation in presence of 2.0 uM ATP by HTRF assay

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192498
PNG
((3-chloro-4-fluoro-benzyl)-(7,8-dimethoxy-10,11-di...)
Show SMILES COc1cc2CNc3c(NCc4ccc(F)c(Cl)c4)ncnc3Nc2cc1OC
Show InChI InChI=1S/C20H19ClFN5O2/c1-28-16-6-12-9-23-18-19(24-8-11-3-4-14(22)13(21)5-11)25-10-26-20(18)27-15(12)7-17(16)29-2/h3-7,10,23H,8-9H2,1-2H3,(H2,24,25,26,27)
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n/an/a 1.60E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR autophosphorylation in DiFi cells by ELISA

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50180444
PNG
(CHEMBL203132 | N*1*-(3-Bromo-phenyl)-10,11-dihydro...)
Show SMILES Nc1ccc2Oc3ncnc(Nc4cccc(Br)c4)c3NCc2c1
Show InChI InChI=1S/C17H14BrN5O/c18-11-2-1-3-13(7-11)23-16-15-17(22-9-21-16)24-14-5-4-12(19)6-10(14)8-20-15/h1-7,9,20H,8,19H2,(H,21,22,23)
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n/an/a 1.70E+3n/an/an/an/an/an/a



ImClone Systems

Curated by ChEMBL


Assay Description
Inhibition of EGFR

Bioorg Med Chem Lett 16: 1643-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.12.018
BindingDB Entry DOI: 10.7270/Q2XP74JC
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))		BDBM50192478
PNG
(1-(3-bromo-phenoxy)-7,8-dimethoxy-10,11-dihydro-5-...)
Show SMILES COc1cc2CNc3c(Oc4cccc(Br)c4)ncnc3Oc2cc1OC
Show InChI InChI=1S/C19H16BrN3O4/c1-24-15-6-11-9-21-17-18(26-13-5-3-4-12(20)7-13)22-10-23-19(17)27-14(11)8-16(15)25-2/h3-8,10,21H,9H2,1-2H3
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n/an/a 1.80E+3n/an/an/an/an/an/a



ImClone Systems Inc

Curated by ChEMBL


Assay Description
Inhibition of EGFR autophosphorylation in DiFi cells by ELISA

Bioorg Med Chem Lett 16: 5102-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.031
BindingDB Entry DOI: 10.7270/Q2K9374T
More data for this
Ligand-Target Pair
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