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PubMed code 22169262

Compile data set for download or QSAR
Found 26 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
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361196
PNG
(CHEMBL1934327)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5cccc(F)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C28H29FN6O2/c1-35-13-11-19(12-14-35)17-37-24-9-10-25-26(16-24)30-18-31-27(25)32-21-5-7-22(8-6-21)33-28(36)34-23-4-2-3-20(29)15-23/h2-10,15-16,18-19H,11-14,17H2,1H3,(H,30,31,32)(H2,33,34,36)
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n/an/a 5.5n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Focal adhesion kinase 1/vascular endothelial growth factor receptor 3


(Homo sapiens (Human))
BDBM50361196
PNG
(CHEMBL1934327)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5cccc(F)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C28H29FN6O2/c1-35-13-11-19(12-14-35)17-37-24-9-10-25-26(16-24)30-18-31-27(25)32-21-5-7-22(8-6-21)33-28(36)34-23-4-2-3-20(29)15-23/h2-10,15-16,18-19H,11-14,17H2,1H3,(H,30,31,32)(H2,33,34,36)
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n/an/a 9.60n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR3


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361200
PNG
(CHEMBL1934331)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5cccc(F)c5)c(F)c4)ncnc3c2)CC1
Show InChI InChI=1S/C28H28F2N6O2/c1-36-11-9-18(10-12-36)16-38-22-6-7-23-26(15-22)31-17-32-27(23)33-21-5-8-25(24(30)14-21)35-28(37)34-20-4-2-3-19(29)13-20/h2-8,13-15,17-18H,9-12,16H2,1H3,(H,31,32,33)(H2,34,35,37)
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n/an/a 15n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361202
PNG
(CHEMBL1933080)
Show SMILES COc1cc2c(Nc3ccc(NC(=O)Nc4cccc(F)c4)cc3)ncnc2cc1OCC1CCN(C)CC1
Show InChI InChI=1S/C29H31FN6O3/c1-36-12-10-19(11-13-36)17-39-27-16-25-24(15-26(27)38-2)28(32-18-31-25)33-21-6-8-22(9-7-21)34-29(37)35-23-5-3-4-20(30)14-23/h3-9,14-16,18-19H,10-13,17H2,1-2H3,(H,31,32,33)(H2,34,35,37)
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n/an/a 16n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361201
PNG
(CHEMBL1934332)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5cccc(F)c5)c(Cl)c4)ncnc3c2)CC1
Show InChI InChI=1S/C28H28ClFN6O2/c1-36-11-9-18(10-12-36)16-38-22-6-7-23-26(15-22)31-17-32-27(23)33-21-5-8-25(24(29)14-21)35-28(37)34-20-4-2-3-19(30)13-20/h2-8,13-15,17-18H,9-12,16H2,1H3,(H,31,32,33)(H2,34,35,37)
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n/an/a 17n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361203
PNG
(CHEMBL1934333)
Show SMILES COc1cc2c(Nc3ccc(NC(=O)Nc4cccc(F)c4)c(F)c3)ncnc2cc1OCC1CCN(C)CC1
Show InChI InChI=1S/C29H30F2N6O3/c1-37-10-8-18(9-11-37)16-40-27-15-25-22(14-26(27)39-2)28(33-17-32-25)34-21-6-7-24(23(31)13-21)36-29(38)35-20-5-3-4-19(30)12-20/h3-7,12-15,17-18H,8-11,16H2,1-2H3,(H,32,33,34)(H2,35,36,38)
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n/an/a 17n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361195
PNG
(CHEMBL1934326)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5ccc(Cl)c(c5)C(F)(F)F)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C29H28ClF3N6O2/c1-39-12-10-18(11-13-39)16-41-22-7-8-23-26(15-22)34-17-35-27(23)36-19-2-4-20(5-3-19)37-28(40)38-21-6-9-25(30)24(14-21)29(31,32)33/h2-9,14-15,17-18H,10-13,16H2,1H3,(H,34,35,36)(H2,37,38,40)
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n/an/a 23n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361197
PNG
(CHEMBL1934328)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5ccc(F)c(F)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C28H28F2N6O2/c1-36-12-10-18(11-13-36)16-38-22-7-8-23-26(15-22)31-17-32-27(23)33-19-2-4-20(5-3-19)34-28(37)35-21-6-9-24(29)25(30)14-21/h2-9,14-15,17-18H,10-13,16H2,1H3,(H,31,32,33)(H2,34,35,37)
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n/an/a 25n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM21
PNG
(6-[(4R,5S,6S,7R)-4,7-dibenzyl-3-(5-carboxypentyl)-...)
Show SMILES COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC1CCN(C)CC1
Show InChI InChI=1S/C22H24BrFN4O2/c1-28-7-5-14(6-8-28)12-30-21-11-19-16(10-20(21)29-2)22(26-13-25-19)27-18-4-3-15(23)9-17(18)24/h3-4,9-11,13-14H,5-8,12H2,1-2H3,(H,25,26,27)
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n/an/a 35n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361198
PNG
(CHEMBL1934329)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5ccc(C)c(Br)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C29H31BrN6O2/c1-19-3-4-23(15-26(19)30)35-29(37)34-22-7-5-21(6-8-22)33-28-25-10-9-24(16-27(25)31-18-32-28)38-17-20-11-13-36(2)14-12-20/h3-10,15-16,18,20H,11-14,17H2,1-2H3,(H,31,32,33)(H2,34,35,37)
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n/an/a 45n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361199
PNG
(CHEMBL1934330)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5ccc(Br)cc5F)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C28H28BrFN6O2/c1-36-12-10-18(11-13-36)16-38-22-7-8-23-26(15-22)31-17-32-27(23)33-20-3-5-21(6-4-20)34-28(37)35-25-9-2-19(29)14-24(25)30/h2-9,14-15,17-18H,10-13,16H2,1H3,(H,31,32,33)(H2,34,35,37)
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n/an/a 50n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361190
PNG
(CHEMBL1934321)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(CC(=O)Nc5cccc(F)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C29H30FN5O2/c1-35-13-11-21(12-14-35)18-37-25-9-10-26-27(17-25)31-19-32-29(26)34-23-7-5-20(6-8-23)15-28(36)33-24-4-2-3-22(30)16-24/h2-10,16-17,19,21H,11-15,18H2,1H3,(H,33,36)(H,31,32,34)
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n/an/a 65n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361191
PNG
(CHEMBL1934322)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(CC(=O)Nc5ccc(F)c(F)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C29H29F2N5O2/c1-36-12-10-20(11-13-36)17-38-23-7-8-24-27(16-23)32-18-33-29(24)35-21-4-2-19(3-5-21)14-28(37)34-22-6-9-25(30)26(31)15-22/h2-9,15-16,18,20H,10-14,17H2,1H3,(H,34,37)(H,32,33,35)
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n/an/a 73n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361189
PNG
(CHEMBL1934320)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(CC(=O)Nc5ccc(Cl)c(c5)C(F)(F)F)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C30H29ClF3N5O2/c1-39-12-10-20(11-13-39)17-41-23-7-8-24-27(16-23)35-18-36-29(24)38-21-4-2-19(3-5-21)14-28(40)37-22-6-9-26(31)25(15-22)30(32,33)34/h2-9,15-16,18,20H,10-14,17H2,1H3,(H,37,40)(H,35,36,38)
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n/an/a 87n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361193
PNG
(CHEMBL1934324)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)NC5CC5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C25H30N6O2/c1-31-12-10-17(11-13-31)15-33-21-8-9-22-23(14-21)26-16-27-24(22)28-18-2-4-19(5-3-18)29-25(32)30-20-6-7-20/h2-5,8-9,14,16-17,20H,6-7,10-13,15H2,1H3,(H,26,27,28)(H2,29,30,32)
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n/an/a 98n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361192
PNG
(CHEMBL1934323)
Show SMILES CCNC(=O)Nc1ccc(Nc2ncnc3cc(OCC4CCN(C)CC4)ccc23)cc1
Show InChI InChI=1S/C24H30N6O2/c1-3-25-24(31)29-19-6-4-18(5-7-19)28-23-21-9-8-20(14-22(21)26-16-27-23)32-15-17-10-12-30(2)13-11-17/h4-9,14,16-17H,3,10-13,15H2,1-2H3,(H2,25,29,31)(H,26,27,28)
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n/an/a 105n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361194
PNG
(CHEMBL1934325)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)NC5CCCCC5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C28H36N6O2/c1-34-15-13-20(14-16-34)18-36-24-11-12-25-26(17-24)29-19-30-27(25)31-22-7-9-23(10-8-22)33-28(35)32-21-5-3-2-4-6-21/h7-12,17,19-21H,2-6,13-16,18H2,1H3,(H,29,30,31)(H2,32,33,35)
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n/an/a 237n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human GST-tagged VEGFR2 intracellular domain using biotin-aminohexyl-EEEEYFELVAKKKK-NH2 as substrate after 30 mins by HTRF assay


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor


(Homo sapiens (Human))
BDBM50361196
PNG
(CHEMBL1934327)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5cccc(F)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C28H29FN6O2/c1-35-13-11-19(12-14-35)17-37-24-9-10-25-26(16-24)30-18-31-27(25)32-21-5-7-22(8-6-21)33-28(36)34-23-4-2-3-20(29)15-23/h2-10,15-16,18-19H,11-14,17H2,1H3,(H,30,31,32)(H2,33,34,36)
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n/an/a 1.36E+3n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRalpha


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50361196
PNG
(CHEMBL1934327)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5cccc(F)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C28H29FN6O2/c1-35-13-11-19(12-14-35)17-37-24-9-10-25-26(16-24)30-18-31-27(25)32-21-5-7-22(8-6-21)33-28(36)34-23-4-2-3-20(29)15-23/h2-10,15-16,18-19H,11-14,17H2,1H3,(H,30,31,32)(H2,33,34,36)
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n/an/a 1.92E+3n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Aurora kinase A


(Homo sapiens (Human))
BDBM50361196
PNG
(CHEMBL1934327)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5cccc(F)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C28H29FN6O2/c1-35-13-11-19(12-14-35)17-37-24-9-10-25-26(16-24)30-18-31-27(25)32-21-5-7-22(8-6-21)33-28(36)34-23-4-2-3-20(29)15-23/h2-10,15-16,18-19H,11-14,17H2,1H3,(H,30,31,32)(H2,33,34,36)
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n/an/a 2.68E+3n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of aurora-A


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))
BDBM50361196
PNG
(CHEMBL1934327)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5cccc(F)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C28H29FN6O2/c1-35-13-11-19(12-14-35)17-37-24-9-10-25-26(16-24)30-18-31-27(25)32-21-5-7-22(8-6-21)33-28(36)34-23-4-2-3-20(29)15-23/h2-10,15-16,18-19H,11-14,17H2,1H3,(H,30,31,32)(H2,33,34,36)
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n/an/a 2.79E+3n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRbeta


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2 and tyrosine-protein kinase TIE-2 (KDR and TIE2)


(Homo sapiens (Human))
BDBM50361196
PNG
(CHEMBL1934327)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5cccc(F)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C28H29FN6O2/c1-35-13-11-19(12-14-35)17-37-24-9-10-25-26(16-24)30-18-31-27(25)32-21-5-7-22(8-6-21)33-28(36)34-23-4-2-3-20(29)15-23/h2-10,15-16,18-19H,11-14,17H2,1H3,(H,30,31,32)(H2,33,34,36)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of Tie2


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Receptor tyrosine-protein kinase erbB-2


(Homo sapiens (Human))
BDBM50361196
PNG
(CHEMBL1934327)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5cccc(F)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C28H29FN6O2/c1-35-13-11-19(12-14-35)17-37-24-9-10-25-26(16-24)30-18-31-27(25)32-21-5-7-22(8-6-21)33-28(36)34-23-4-2-3-20(29)15-23/h2-10,15-16,18-19H,11-14,17H2,1H3,(H,30,31,32)(H2,33,34,36)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of HER2


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))
BDBM50361196
PNG
(CHEMBL1934327)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5cccc(F)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C28H29FN6O2/c1-35-13-11-19(12-14-35)17-37-24-9-10-25-26(16-24)30-18-31-27(25)32-21-5-7-22(8-6-21)33-28(36)34-23-4-2-3-20(29)15-23/h2-10,15-16,18-19H,11-14,17H2,1H3,(H,30,31,32)(H2,33,34,36)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of FGFR1


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Epidermal growth factor receptor


(Homo sapiens (Human))
BDBM50361196
PNG
(CHEMBL1934327)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5cccc(F)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C28H29FN6O2/c1-35-13-11-19(12-14-35)17-37-24-9-10-25-26(16-24)30-18-31-27(25)32-21-5-7-22(8-6-21)33-28(36)34-23-4-2-3-20(29)15-23/h2-10,15-16,18-19H,11-14,17H2,1H3,(H,30,31,32)(H2,33,34,36)
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Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of EGFR


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
Cyclin-dependent kinase 1


(Homo sapiens (Human))
BDBM50361196
PNG
(CHEMBL1934327)
Show SMILES CN1CCC(COc2ccc3c(Nc4ccc(NC(=O)Nc5cccc(F)c5)cc4)ncnc3c2)CC1
Show InChI InChI=1S/C28H29FN6O2/c1-35-13-11-19(12-14-35)17-37-24-9-10-25-26(16-24)30-18-31-27(25)32-21-5-7-22(8-6-21)33-28(36)34-23-4-2-3-20(29)15-23/h2-10,15-16,18-19H,11-14,17H2,1H3,(H,30,31,32)(H2,33,34,36)
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n/an/a 1.00E+4n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of CDK1


Bioorg Med Chem Lett 22: 110-4 (2011)


Article DOI: 10.1016/j.bmcl.2011.11.061
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%