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PubMed code 26843921

Compile data set for download or QSAR
Found 39 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
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498459
PNG
(CHEMBL3596892)
Show SMILES Cn1cc(cn1)-c1cncc(n1)-c1ccc(NC(=O)Nc2cc(no2)C(C)(C)C)cc1
Show InChI InChI=1S/C22H23N7O2/c1-22(2,3)19-9-20(31-28-19)27-21(30)25-16-7-5-14(6-8-16)17-11-23-12-18(26-17)15-10-24-29(4)13-15/h5-13H,1-4H3,(H2,25,27,30)
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n/an/a 5n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498457
PNG
(CHEMBL3596893)
Show SMILES Cn1cc(cn1)-c1cncc(n1)-c1ccc(NC(=O)Nc2cc(nn2C)C(C)(C)C)cc1
Show InChI InChI=1S/C23H26N8O/c1-23(2,3)20-10-21(31(5)29-20)28-22(32)26-17-8-6-15(7-9-17)18-12-24-13-19(27-18)16-11-25-30(4)14-16/h6-14H,1-5H3,(H2,26,28,32)
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n/an/a 12n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498449
PNG
(CHEMBL3596889)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccc(F)cc3)c2)no1
Show InChI InChI=1S/C24H22FN5O3/c1-24(2,3)20-12-21(30-33-20)29-23(31)27-17-5-4-6-18(11-17)32-22-14-26-13-19(28-22)15-7-9-16(25)10-8-15/h4-14H,1-3H3,(H2,27,29,30,31)
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n/an/a 22n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498455
PNG
(CHEMBL3596879)
Show SMILES Cn1cc(cn1)-c1cncc(Oc2cccc(NC(=O)Nc3cc(on3)C(C)(C)C)c2)n1
Show InChI InChI=1S/C22H23N7O3/c1-22(2,3)18-9-19(28-32-18)27-21(30)25-15-6-5-7-16(8-15)31-20-12-23-11-17(26-20)14-10-24-29(4)13-14/h5-13H,1-4H3,(H2,25,27,28,30)
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n/an/a 24n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498458
PNG
(CHEMBL3596868)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccsc3)c2)no1
Show InChI InChI=1S/C22H21N5O3S/c1-22(2,3)18-10-19(27-30-18)26-21(28)24-15-5-4-6-16(9-15)29-20-12-23-11-17(25-20)14-7-8-31-13-14/h4-13H,1-3H3,(H2,24,26,27,28)
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n/an/a 39n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498453
PNG
(CHEMBL3596862)
Show SMILES COc1ccc(cc1)-c1cncc(Oc2cccc(NC(=O)Nc3cc(on3)C(C)(C)C)c2)n1
Show InChI InChI=1S/C25H25N5O4/c1-25(2,3)21-13-22(30-34-21)29-24(31)27-17-6-5-7-19(12-17)33-23-15-26-14-20(28-23)16-8-10-18(32-4)11-9-16/h5-15H,1-4H3,(H2,27,29,30,31)
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The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))		BDBM50498449
PNG
(CHEMBL3596889)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccc(F)cc3)c2)no1
Show InChI InChI=1S/C24H22FN5O3/c1-24(2,3)20-12-21(30-33-20)29-23(31)27-17-5-4-6-18(11-17)32-22-14-26-13-19(28-22)15-7-9-16(25)10-8-15/h4-14H,1-3H3,(H2,27,29,30,31)
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The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of RET (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))		BDBM50498459
PNG
(CHEMBL3596892)
Show SMILES Cn1cc(cn1)-c1cncc(n1)-c1ccc(NC(=O)Nc2cc(no2)C(C)(C)C)cc1
Show InChI InChI=1S/C22H23N7O2/c1-22(2,3)19-9-20(31-28-19)27-21(30)25-16-7-5-14(6-8-16)17-11-23-12-18(26-17)15-10-24-29(4)13-15/h5-13H,1-4H3,(H2,25,27,30)
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n/an/a 63n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of RET (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))		BDBM50498457
PNG
(CHEMBL3596893)
Show SMILES Cn1cc(cn1)-c1cncc(n1)-c1ccc(NC(=O)Nc2cc(nn2C)C(C)(C)C)cc1
Show InChI InChI=1S/C23H26N8O/c1-23(2,3)20-10-21(31(5)29-20)28-22(32)26-17-8-6-15(7-9-17)18-12-24-13-19(27-18)16-11-25-30(4)14-16/h6-14H,1-5H3,(H2,26,28,32)
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n/an/a 64n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of RET (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498452
PNG
(CHEMBL3596873)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccc(cc3)S(C)(=O)=O)c2)no1
Show InChI InChI=1S/C25H25N5O5S/c1-25(2,3)21-13-22(30-35-21)29-24(31)27-17-6-5-7-18(12-17)34-23-15-26-14-20(28-23)16-8-10-19(11-9-16)36(4,32)33/h5-15H,1-4H3,(H2,27,29,30,31)
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n/an/a 92n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))		BDBM50498458
PNG
(CHEMBL3596868)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccsc3)c2)no1
Show InChI InChI=1S/C22H21N5O3S/c1-22(2,3)18-10-19(27-30-18)26-21(28)24-15-5-4-6-16(9-15)29-20-12-23-11-17(25-20)14-7-8-31-13-14/h4-13H,1-3H3,(H2,24,26,27,28)
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The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of RET (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))		BDBM50498453
PNG
(CHEMBL3596862)
Show SMILES COc1ccc(cc1)-c1cncc(Oc2cccc(NC(=O)Nc3cc(on3)C(C)(C)C)c2)n1
Show InChI InChI=1S/C25H25N5O4/c1-25(2,3)21-13-22(30-34-21)29-24(31)27-17-6-5-7-19(12-17)33-23-15-26-14-20(28-23)16-8-10-18(32-4)11-9-16/h5-15H,1-4H3,(H2,27,29,30,31)
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The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of RET (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))		BDBM50498452
PNG
(CHEMBL3596873)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccc(cc3)S(C)(=O)=O)c2)no1
Show InChI InChI=1S/C25H25N5O5S/c1-25(2,3)21-13-22(30-35-21)29-24(31)27-17-6-5-7-18(12-17)34-23-15-26-14-20(28-23)16-8-10-19(11-9-16)36(4,32)33/h5-15H,1-4H3,(H2,27,29,30,31)
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The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of RET (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Proto-oncogene tyrosine-protein kinase receptor Ret


(Homo sapiens (Human))		BDBM50498455
PNG
(CHEMBL3596879)
Show SMILES Cn1cc(cn1)-c1cncc(Oc2cccc(NC(=O)Nc3cc(on3)C(C)(C)C)c2)n1
Show InChI InChI=1S/C22H23N7O3/c1-22(2,3)18-9-19(28-32-18)27-21(30)25-15-6-5-7-16(8-15)31-20-12-23-11-17(26-20)14-10-24-29(4)13-14/h5-13H,1-4H3,(H2,25,27,28,30)
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n/an/a 330n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of RET (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498460
PNG
(CHEMBL3596858)
Show SMILES COc1ccc(cc1)-c1cncc(Oc2cccc(NC(=O)Nc3ccc(cc3)C(C)C)c2)n1
Show InChI InChI=1S/C27H26N4O3/c1-18(2)19-7-11-21(12-8-19)29-27(32)30-22-5-4-6-24(15-22)34-26-17-28-16-25(31-26)20-9-13-23(33-3)14-10-20/h4-18H,1-3H3,(H2,29,30,32)
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The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498462
PNG
(CHEMBL3596870)
Show SMILES CC(C)c1ccc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccc(cc3)S(C)(=O)=O)c2)cc1
Show InChI InChI=1S/C27H26N4O4S/c1-18(2)19-7-11-21(12-8-19)29-27(32)30-22-5-4-6-23(15-22)35-26-17-28-16-25(31-26)20-9-13-24(14-10-20)36(3,33)34/h4-18H,1-3H3,(H2,29,30,32)
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n/an/a 420n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498456
PNG
(CHEMBL3596874)
Show SMILES Cn1nc(cc1NC(=O)Nc1cccc(Oc2cncc(n2)-c2ccc(cc2)S(C)(=O)=O)c1)C(C)(C)C
Show InChI InChI=1S/C26H28N6O4S/c1-26(2,3)22-14-23(32(4)31-22)30-25(33)28-18-7-6-8-19(13-18)36-24-16-27-15-21(29-24)17-9-11-20(12-10-17)37(5,34)35/h6-16H,1-5H3,(H2,28,30,33)
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n/an/a 490n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498454
PNG
(CHEMBL3596876)
Show SMILES Cn1cc(cn1)-c1cncc(Oc2cccc(NC(=O)Nc3cccc(c3)C(F)(F)F)c2)n1
Show InChI InChI=1S/C22H17F3N6O2/c1-31-13-14(10-27-31)19-11-26-12-20(30-19)33-18-7-3-6-17(9-18)29-21(32)28-16-5-2-4-15(8-16)22(23,24)25/h2-13H,1H3,(H2,28,29,32)
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n/an/a 530n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498450
PNG
(CHEMBL3596864)
Show SMILES CC(C)c1ccc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccsc3)c2)cc1
Show InChI InChI=1S/C24H22N4O2S/c1-16(2)17-6-8-19(9-7-17)26-24(29)27-20-4-3-5-21(12-20)30-23-14-25-13-22(28-23)18-10-11-31-15-18/h3-16H,1-2H3,(H2,26,27,29)
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n/an/a 870n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Ephrin type-B receptor 2


(Homo sapiens (Human))		BDBM50498455
PNG
(CHEMBL3596879)
Show SMILES Cn1cc(cn1)-c1cncc(Oc2cccc(NC(=O)Nc3cc(on3)C(C)(C)C)c2)n1
Show InChI InChI=1S/C22H23N7O3/c1-22(2,3)18-9-19(28-32-18)27-21(30)25-15-6-5-7-16(8-15)31-20-12-23-11-17(26-20)14-10-24-29(4)13-14/h5-13H,1-4H3,(H2,25,27,28,30)
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n/an/a 880n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of EphB2 (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50498457
PNG
(CHEMBL3596893)
Show SMILES Cn1cc(cn1)-c1cncc(n1)-c1ccc(NC(=O)Nc2cc(nn2C)C(C)(C)C)cc1
Show InChI InChI=1S/C23H26N8O/c1-23(2,3)20-10-21(31(5)29-20)28-22(32)26-17-8-6-15(7-9-17)18-12-24-13-19(27-18)16-11-25-30(4)14-16/h6-14H,1-5H3,(H2,26,28,32)
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n/an/a 960n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of KDR (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50498459
PNG
(CHEMBL3596892)
Show SMILES Cn1cc(cn1)-c1cncc(n1)-c1ccc(NC(=O)Nc2cc(no2)C(C)(C)C)cc1
Show InChI InChI=1S/C22H23N7O2/c1-22(2,3)19-9-20(31-28-19)27-21(30)25-16-7-5-14(6-8-16)17-11-23-12-18(26-17)15-10-24-29(4)13-15/h5-13H,1-4H3,(H2,25,27,30)
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n/an/a 1.00E+3n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of KDR (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498465
PNG
(CHEMBL3596865)
Show SMILES FC(F)(F)c1cccc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccsc3)c2)c1
Show InChI InChI=1S/C22H15F3N4O2S/c23-22(24,25)15-3-1-4-16(9-15)27-21(30)28-17-5-2-6-18(10-17)31-20-12-26-11-19(29-20)14-7-8-32-13-14/h1-13H,(H2,27,28,30)
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n/an/a 1.10E+3n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50498455
PNG
(CHEMBL3596879)
Show SMILES Cn1cc(cn1)-c1cncc(Oc2cccc(NC(=O)Nc3cc(on3)C(C)(C)C)c2)n1
Show InChI InChI=1S/C22H23N7O3/c1-22(2,3)18-9-19(28-32-18)27-21(30)25-15-6-5-7-16(8-15)31-20-12-23-11-17(26-20)14-10-24-29(4)13-14/h5-13H,1-4H3,(H2,25,27,28,30)
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n/an/a 1.40E+3n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of KDR (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498466
PNG
(CHEMBL3596859)
Show SMILES COc1ccc(cc1)-c1cncc(Oc2cccc(NC(=O)Nc3cccc(c3)C(F)(F)F)c2)n1
Show InChI InChI=1S/C25H19F3N4O3/c1-34-20-10-8-16(9-11-20)22-14-29-15-23(32-22)35-21-7-3-6-19(13-21)31-24(33)30-18-5-2-4-17(12-18)25(26,27)28/h2-15H,1H3,(H2,30,31,33)
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n/an/a 1.60E+3n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498463
PNG
(CHEMBL3596871)
Show SMILES CS(=O)(=O)c1ccc(cc1)-c1cncc(Oc2cccc(NC(=O)Nc3cccc(c3)C(F)(F)F)c2)n1
Show InChI InChI=1S/C25H19F3N4O4S/c1-37(34,35)21-10-8-16(9-11-21)22-14-29-15-23(32-22)36-20-7-3-6-19(13-20)31-24(33)30-18-5-2-4-17(12-18)25(26,27)28/h2-15H,1H3,(H2,30,31,33)
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n/an/a 1.70E+3n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Ephrin type-B receptor 2


(Homo sapiens (Human))		BDBM50498458
PNG
(CHEMBL3596868)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccsc3)c2)no1
Show InChI InChI=1S/C22H21N5O3S/c1-22(2,3)18-10-19(27-30-18)26-21(28)24-15-5-4-6-16(9-15)29-20-12-23-11-17(25-20)14-7-8-31-13-14/h4-13H,1-3H3,(H2,24,26,27,28)
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n/an/a>2.00E+3n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of EphB2 (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Ephrin type-B receptor 2


(Homo sapiens (Human))		BDBM50498449
PNG
(CHEMBL3596889)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccc(F)cc3)c2)no1
Show InChI InChI=1S/C24H22FN5O3/c1-24(2,3)20-12-21(30-33-20)29-23(31)27-17-5-4-6-18(11-17)32-22-14-26-13-19(28-22)15-7-9-16(25)10-8-15/h4-14H,1-3H3,(H2,27,29,30,31)
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The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of EphB2 (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Ephrin type-B receptor 2


(Homo sapiens (Human))		BDBM50498453
PNG
(CHEMBL3596862)
Show SMILES COc1ccc(cc1)-c1cncc(Oc2cccc(NC(=O)Nc3cc(on3)C(C)(C)C)c2)n1
Show InChI InChI=1S/C25H25N5O4/c1-25(2,3)21-13-22(30-34-21)29-24(31)27-17-6-5-7-19(12-17)33-23-15-26-14-20(28-23)16-8-10-18(32-4)11-9-16/h5-15H,1-4H3,(H2,27,29,30,31)
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The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of EphB2 (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50498458
PNG
(CHEMBL3596868)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccsc3)c2)no1
Show InChI InChI=1S/C22H21N5O3S/c1-22(2,3)18-10-19(27-30-18)26-21(28)24-15-5-4-6-16(9-15)29-20-12-23-11-17(25-20)14-7-8-31-13-14/h4-13H,1-3H3,(H2,24,26,27,28)
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The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of KDR (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Ephrin type-B receptor 2


(Homo sapiens (Human))		BDBM50498452
PNG
(CHEMBL3596873)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccc(cc3)S(C)(=O)=O)c2)no1
Show InChI InChI=1S/C25H25N5O5S/c1-25(2,3)21-13-22(30-35-21)29-24(31)27-17-6-5-7-18(12-17)34-23-15-26-14-20(28-23)16-8-10-19(11-9-16)36(4,32)33/h5-15H,1-4H3,(H2,27,29,30,31)
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The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of EphB2 (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50498449
PNG
(CHEMBL3596889)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccc(F)cc3)c2)no1
Show InChI InChI=1S/C24H22FN5O3/c1-24(2,3)20-12-21(30-33-20)29-23(31)27-17-5-4-6-18(11-17)32-22-14-26-13-19(28-22)15-7-9-16(25)10-8-15/h4-14H,1-3H3,(H2,27,29,30,31)
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The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of KDR (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50498453
PNG
(CHEMBL3596862)
Show SMILES COc1ccc(cc1)-c1cncc(Oc2cccc(NC(=O)Nc3cc(on3)C(C)(C)C)c2)n1
Show InChI InChI=1S/C25H25N5O4/c1-25(2,3)21-13-22(30-34-21)29-24(31)27-17-6-5-7-19(12-17)33-23-15-26-14-20(28-23)16-8-10-18(32-4)11-9-16/h5-15H,1-4H3,(H2,27,29,30,31)
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The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of KDR (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Ephrin type-B receptor 2


(Homo sapiens (Human))		BDBM50498457
PNG
(CHEMBL3596893)
Show SMILES Cn1cc(cn1)-c1cncc(n1)-c1ccc(NC(=O)Nc2cc(nn2C)C(C)(C)C)cc1
Show InChI InChI=1S/C23H26N8O/c1-23(2,3)20-10-21(31(5)29-20)28-22(32)26-17-8-6-15(7-9-17)18-12-24-13-19(27-18)16-11-25-30(4)14-16/h6-14H,1-5H3,(H2,26,28,32)
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n/an/a 2.20E+3n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of EphB2 (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Ephrin type-B receptor 2


(Homo sapiens (Human))		BDBM50498459
PNG
(CHEMBL3596892)
Show SMILES Cn1cc(cn1)-c1cncc(n1)-c1ccc(NC(=O)Nc2cc(no2)C(C)(C)C)cc1
Show InChI InChI=1S/C22H23N7O2/c1-22(2,3)19-9-20(31-28-19)27-21(30)25-16-7-5-14(6-8-16)17-11-23-12-18(26-17)15-10-24-29(4)13-15/h5-13H,1-4H3,(H2,25,27,30)
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n/an/a 2.90E+3n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of EphB2 (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498464
PNG
(CHEMBL3596855)
Show SMILES FC(F)(F)c1cccc(NC(=O)Nc2cccc(Oc3cncc(Cl)n3)c2)c1
Show InChI InChI=1S/C18H12ClF3N4O2/c19-15-9-23-10-16(26-15)28-14-6-2-5-13(8-14)25-17(27)24-12-4-1-3-11(7-12)18(20,21)22/h1-10H,(H2,24,25,27)
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n/an/a 3.50E+3n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50498452
PNG
(CHEMBL3596873)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cncc(n3)-c3ccc(cc3)S(C)(=O)=O)c2)no1
Show InChI InChI=1S/C25H25N5O5S/c1-25(2,3)21-13-22(30-35-21)29-24(31)27-17-6-5-7-18(12-17)34-23-15-26-14-20(28-23)16-8-10-19(11-9-16)36(4,32)33/h5-15H,1-4H3,(H2,27,29,30,31)
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n/an/a 4.80E+3n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of KDR (unknown origin) using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498451
PNG
(CHEMBL3596857)
Show SMILES CC(C)(C)c1cccc(NC(=O)Nc2cccc(Oc3cncc(Cl)n3)c2)c1
Show InChI InChI=1S/C21H21ClN4O2/c1-21(2,3)14-6-4-7-15(10-14)24-20(27)25-16-8-5-9-17(11-16)28-19-13-23-12-18(22)26-19/h4-13H,1-3H3,(H2,24,25,27)
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The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
High affinity nerve growth factor receptor


(Homo sapiens (Human))		BDBM50498461
PNG
(CHEMBL3596856)
Show SMILES CC(C)(C)c1cc(NC(=O)Nc2cccc(Oc3cncc(Cl)n3)c2)no1
Show InChI InChI=1S/C18H18ClN5O3/c1-18(2,3)13-8-15(24-27-13)23-17(25)21-11-5-4-6-12(7-11)26-16-10-20-9-14(19)22-16/h4-10H,1-3H3,(H2,21,23,24,25)
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n/an/a>1.00E+5n/an/an/an/an/an/a



The University of Arizona

Curated by ChEMBL


Assay Description
Inhibition of human recombinant TrkA using ATP and 5FAM tagged TrkA peptide substrate incubated for 60 mins by microfluidics assay

Medchemcomm 5: 1507-1514 (2014)


Article DOI: 10.1039/c4md00251b
BindingDB Entry DOI: 10.7270/Q2WW7MQ5
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%