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PubMed code 28190652

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
Platelet-derived growth factor receptor alpha


(Homo sapiens (Human))		BDBM50026612
PNG
(BIBF-1120 | Nintedanib | US10981896, Compound Nint...)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)N(C)C(=O)CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C31H33N5O4/c1-34-15-17-36(18-16-34)20-27(37)35(2)24-12-10-23(11-13-24)32-29(21-7-5-4-6-8-21)28-25-14-9-22(31(39)40-3)19-26(25)33-30(28)38/h4-14,19,32H,15-18,20H2,1-3H3,(H,33,38)/b29-28-
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n/an/a 1.90n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of PDGFRalpha (unknown origin) preincubated for 10 mins followed by FAM-labeled peptide substrate addition measured after 1 hr by mobility...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 3


(Homo sapiens (Human))		BDBM50026612
PNG
(BIBF-1120 | Nintedanib | US10981896, Compound Nint...)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)N(C)C(=O)CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C31H33N5O4/c1-34-15-17-36(18-16-34)20-27(37)35(2)24-12-10-23(11-13-24)32-29(21-7-5-4-6-8-21)28-25-14-9-22(31(39)40-3)19-26(25)33-30(28)38/h4-14,19,32H,15-18,20H2,1-3H3,(H,33,38)/b29-28-
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n/an/a 3n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GST-tagged VEGFR3 cytoplasmic domain expressed in baculovirus expression system preincubated for 10 mins followed by ...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50026612
PNG
(BIBF-1120 | Nintedanib | US10981896, Compound Nint...)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)N(C)C(=O)CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C31H33N5O4/c1-34-15-17-36(18-16-34)20-27(37)35(2)24-12-10-23(11-13-24)32-29(21-7-5-4-6-8-21)28-25-14-9-22(31(39)40-3)19-26(25)33-30(28)38/h4-14,19,32H,15-18,20H2,1-3H3,(H,33,38)/b29-28-
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n/an/a 3.30n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged VEGFR2 cytoplasmic domain (790 to 1356 residues) expressed in baculovirus expression system preincubated fo...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair		3D
3D Structure (crystal)
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))		BDBM50026612
PNG
(BIBF-1120 | Nintedanib | US10981896, Compound Nint...)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)N(C)C(=O)CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C31H33N5O4/c1-34-15-17-36(18-16-34)20-27(37)35(2)24-12-10-23(11-13-24)32-29(21-7-5-4-6-8-21)28-25-14-9-22(31(39)40-3)19-26(25)33-30(28)38/h4-14,19,32H,15-18,20H2,1-3H3,(H,33,38)/b29-28-
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n/an/a 3.70n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged PDGFRbeta cytoplasmic domain (557 to 1106 residues) expressed in baculovirus expression system preincubated...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha


(Homo sapiens (Human))		BDBM50230972
PNG
(CHEMBL4069394)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN(C)C)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C30H28N4O3/c1-33(2)19-24-10-7-17-34(24)23-14-12-22(13-15-23)31-28(20-8-5-4-6-9-20)27-25-16-11-21(30(36)37-3)18-26(25)32-29(27)35/h4-18,31H,19H2,1-3H3,(H,32,35)/b28-27-
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n/an/a 6.60n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of PDGFRalpha (unknown origin) preincubated for 10 mins followed by FAM-labeled peptide substrate addition measured after 1 hr by mobility...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 3


(Homo sapiens (Human))		BDBM50230972
PNG
(CHEMBL4069394)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN(C)C)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C30H28N4O3/c1-33(2)19-24-10-7-17-34(24)23-14-12-22(13-15-23)31-28(20-8-5-4-6-9-20)27-25-16-11-21(30(36)37-3)18-26(25)32-29(27)35/h4-18,31H,19H2,1-3H3,(H,32,35)/b28-27-
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n/an/a 9.60n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GST-tagged VEGFR3 cytoplasmic domain expressed in baculovirus expression system preincubated for 10 mins followed by ...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))		BDBM50230972
PNG
(CHEMBL4069394)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN(C)C)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C30H28N4O3/c1-33(2)19-24-10-7-17-34(24)23-14-12-22(13-15-23)31-28(20-8-5-4-6-9-20)27-25-16-11-21(30(36)37-3)18-26(25)32-29(27)35/h4-18,31H,19H2,1-3H3,(H,32,35)/b28-27-
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n/an/a 14n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged PDGFRbeta cytoplasmic domain (557 to 1106 residues) expressed in baculovirus expression system preincubated...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))		BDBM50026612
PNG
(BIBF-1120 | Nintedanib | US10981896, Compound Nint...)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)N(C)C(=O)CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C31H33N5O4/c1-34-15-17-36(18-16-34)20-27(37)35(2)24-12-10-23(11-13-24)32-29(21-7-5-4-6-8-21)28-25-14-9-22(31(39)40-3)19-26(25)33-30(28)38/h4-14,19,32H,15-18,20H2,1-3H3,(H,33,38)/b29-28-
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n/an/a 23n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GST-tagged VEGFR1 cytoplasmic domain (781 to 1338 residues) expressed in baculovirus expression system preincubated f...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))		BDBM50230980
PNG
(CHEMBL4091341)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN3CCCC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C32H30N4O3/c1-39-32(38)23-11-16-27-28(20-23)34-31(37)29(27)30(22-8-3-2-4-9-22)33-24-12-14-25(15-13-24)36-19-7-10-26(36)21-35-17-5-6-18-35/h2-4,7-16,19-20,33H,5-6,17-18,21H2,1H3,(H,34,37)/b30-29-
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n/an/a 27n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged PDGFRbeta cytoplasmic domain (557 to 1106 residues) expressed in baculovirus expression system preincubated...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))		BDBM50230978
PNG
(CHEMBL4086939)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(Cn4cccc4CN(C)C)cc3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C31H30N4O3/c1-34(2)20-25-10-7-17-35(25)19-21-11-14-24(15-12-21)32-29(22-8-5-4-6-9-22)28-26-16-13-23(31(37)38-3)18-27(26)33-30(28)36/h4-18,32H,19-20H2,1-3H3,(H,33,36)/b29-28-
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n/an/a 30n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged PDGFRbeta cytoplasmic domain (557 to 1106 residues) expressed in baculovirus expression system preincubated...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))		BDBM50230974
PNG
(CHEMBL4070403)
Show SMILES CCN(CC)Cc1cccn1-c1ccc(N\C(=C2/C(=O)Nc3cc(ccc23)C(=O)OC)c2ccccc2)cc1
Show InChI InChI=1S/C32H32N4O3/c1-4-35(5-2)21-26-12-9-19-36(26)25-16-14-24(15-17-25)33-30(22-10-7-6-8-11-22)29-27-18-13-23(32(38)39-3)20-28(27)34-31(29)37/h6-20,33H,4-5,21H2,1-3H3,(H,34,37)/b30-29-
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n/an/a 31n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged PDGFRbeta cytoplasmic domain (557 to 1106 residues) expressed in baculovirus expression system preincubated...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50230976
PNG
(CHEMBL4079087)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C33H33N5O3/c1-36-17-19-37(20-18-36)22-27-9-6-16-38(27)26-13-11-25(12-14-26)34-31(23-7-4-3-5-8-23)30-28-15-10-24(33(40)41-2)21-29(28)35-32(30)39/h3-16,21,34H,17-20,22H2,1-2H3,(H,35,39)/b31-30-
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n/an/a 38n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged VEGFR2 cytoplasmic domain (790 to 1356 residues) expressed in baculovirus expression system preincubated fo...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))		BDBM50230975
PNG
(CHEMBL4059568)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN3CCCCC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C33H32N4O3/c1-40-33(39)24-12-17-28-29(21-24)35-32(38)30(28)31(23-9-4-2-5-10-23)34-25-13-15-26(16-14-25)37-20-8-11-27(37)22-36-18-6-3-7-19-36/h2,4-5,8-17,20-21,34H,3,6-7,18-19,22H2,1H3,(H,35,38)/b31-30-
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n/an/a 46n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged PDGFRbeta cytoplasmic domain (557 to 1106 residues) expressed in baculovirus expression system preincubated...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50230972
PNG
(CHEMBL4069394)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN(C)C)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C30H28N4O3/c1-33(2)19-24-10-7-17-34(24)23-14-12-22(13-15-23)31-28(20-8-5-4-6-9-20)27-25-16-11-21(30(36)37-3)18-26(25)32-29(27)35/h4-18,31H,19H2,1-3H3,(H,32,35)/b28-27-
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n/an/a 52n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged VEGFR2 cytoplasmic domain (790 to 1356 residues) expressed in baculovirus expression system preincubated fo...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))		BDBM50230977
PNG
(CHEMBL4061361)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN3CCNCC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C32H31N5O3/c1-40-32(39)23-9-14-27-28(20-23)35-31(38)29(27)30(22-6-3-2-4-7-22)34-24-10-12-25(13-11-24)37-17-5-8-26(37)21-36-18-15-33-16-19-36/h2-14,17,20,33-34H,15-16,18-19,21H2,1H3,(H,35,38)/b30-29-
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n/an/a 65n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged PDGFRbeta cytoplasmic domain (557 to 1106 residues) expressed in baculovirus expression system preincubated...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))		BDBM50230979
PNG
(CHEMBL4098962)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(Cn4cccc4CN4CCN(C)CC4)cc3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C34H35N5O3/c1-37-17-19-38(20-18-37)23-28-9-6-16-39(28)22-24-10-13-27(14-11-24)35-32(25-7-4-3-5-8-25)31-29-15-12-26(34(41)42-2)21-30(29)36-33(31)40/h3-16,21,35H,17-20,22-23H2,1-2H3,(H,36,40)/b32-31-
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n/an/a 68n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged PDGFRbeta cytoplasmic domain (557 to 1106 residues) expressed in baculovirus expression system preincubated...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor beta


(Homo sapiens (Human))		BDBM50230976
PNG
(CHEMBL4079087)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C33H33N5O3/c1-36-17-19-37(20-18-36)22-27-9-6-16-38(27)26-13-11-25(12-14-26)34-31(23-7-4-3-5-8-23)30-28-15-10-24(33(40)41-2)21-29(28)35-32(30)39/h3-16,21,34H,17-20,22H2,1-2H3,(H,35,39)/b31-30-
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n/an/a 83n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged PDGFRbeta cytoplasmic domain (557 to 1106 residues) expressed in baculovirus expression system preincubated...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50230977
PNG
(CHEMBL4061361)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN3CCNCC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C32H31N5O3/c1-40-32(39)23-9-14-27-28(20-23)35-31(38)29(27)30(22-6-3-2-4-7-22)34-24-10-12-25(13-11-24)37-17-5-8-26(37)21-36-18-15-33-16-19-36/h2-14,17,20,33-34H,15-16,18-19,21H2,1H3,(H,35,38)/b30-29-
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n/an/a 96n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged VEGFR2 cytoplasmic domain (790 to 1356 residues) expressed in baculovirus expression system preincubated fo...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))		BDBM50026612
PNG
(BIBF-1120 | Nintedanib | US10981896, Compound Nint...)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)N(C)C(=O)CN3CCN(C)CC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C31H33N5O4/c1-34-15-17-36(18-16-34)20-27(37)35(2)24-12-10-23(11-13-24)32-29(21-7-5-4-6-8-21)28-25-14-9-22(31(39)40-3)19-26(25)33-30(28)38/h4-14,19,32H,15-18,20H2,1-3H3,(H,33,38)/b29-28-
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n/an/a 99n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GST-tagged FGFR1 cytoplasmic domain (398 to 822 residues) expressed in baculovirus expression system preincubated for...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))		BDBM50230972
PNG
(CHEMBL4069394)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN(C)C)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C30H28N4O3/c1-33(2)19-24-10-7-17-34(24)23-14-12-22(13-15-23)31-28(20-8-5-4-6-9-20)27-25-16-11-21(30(36)37-3)18-26(25)32-29(27)35/h4-18,31H,19H2,1-3H3,(H,32,35)/b28-27-
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n/an/a 99n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GST-tagged VEGFR1 cytoplasmic domain (781 to 1338 residues) expressed in baculovirus expression system preincubated f...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50230975
PNG
(CHEMBL4059568)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN3CCCCC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C33H32N4O3/c1-40-33(39)24-12-17-28-29(21-24)35-32(38)30(28)31(23-9-4-2-5-10-23)34-25-13-15-26(16-14-25)37-20-8-11-27(37)22-36-18-6-3-7-19-36/h2,4-5,8-17,20-21,34H,3,6-7,18-19,22H2,1H3,(H,35,38)/b31-30-
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n/an/a 138n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged VEGFR2 cytoplasmic domain (790 to 1356 residues) expressed in baculovirus expression system preincubated fo...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50230980
PNG
(CHEMBL4091341)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN3CCCC3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C32H30N4O3/c1-39-32(38)23-11-16-27-28(20-23)34-31(37)29(27)30(22-8-3-2-4-9-22)33-24-12-14-25(15-13-24)36-19-7-10-26(36)21-35-17-5-6-18-35/h2-4,7-16,19-20,33H,5-6,17-18,21H2,1H3,(H,34,37)/b30-29-
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n/an/a 153n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged VEGFR2 cytoplasmic domain (790 to 1356 residues) expressed in baculovirus expression system preincubated fo...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50230974
PNG
(CHEMBL4070403)
Show SMILES CCN(CC)Cc1cccn1-c1ccc(N\C(=C2/C(=O)Nc3cc(ccc23)C(=O)OC)c2ccccc2)cc1
Show InChI InChI=1S/C32H32N4O3/c1-4-35(5-2)21-26-12-9-19-36(26)25-16-14-24(15-17-25)33-30(22-10-7-6-8-11-22)29-27-18-13-23(32(38)39-3)20-28(27)34-31(29)37/h6-20,33H,4-5,21H2,1-3H3,(H,34,37)/b30-29-
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n/an/a 165n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged VEGFR2 cytoplasmic domain (790 to 1356 residues) expressed in baculovirus expression system preincubated fo...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50230979
PNG
(CHEMBL4098962)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(Cn4cccc4CN4CCN(C)CC4)cc3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C34H35N5O3/c1-37-17-19-38(20-18-37)23-28-9-6-16-39(28)22-24-10-13-27(14-11-24)35-32(25-7-4-3-5-8-25)31-29-15-12-26(34(41)42-2)21-30(29)36-33(31)40/h3-16,21,35H,17-20,22-23H2,1-2H3,(H,36,40)/b32-31-
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n/an/a 165n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged VEGFR2 cytoplasmic domain (790 to 1356 residues) expressed in baculovirus expression system preincubated fo...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))		BDBM50230978
PNG
(CHEMBL4086939)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(Cn4cccc4CN(C)C)cc3)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C31H30N4O3/c1-34(2)20-25-10-7-17-35(25)19-21-11-14-24(15-12-21)32-29(22-8-5-4-6-9-22)28-26-16-13-23(31(37)38-3)18-27(26)33-30(28)36/h4-18,32H,19-20H2,1-3H3,(H,33,36)/b29-28-
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n/an/a 168n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of human N-terminal GST-tagged VEGFR2 cytoplasmic domain (790 to 1356 residues) expressed in baculovirus expression system preincubated fo...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
Fibroblast growth factor receptor 1


(Homo sapiens (Human))		BDBM50230972
PNG
(CHEMBL4069394)
Show SMILES COC(=O)c1ccc2\C(=C(\Nc3ccc(cc3)-n3cccc3CN(C)C)c3ccccc3)C(=O)Nc2c1
Show InChI InChI=1S/C30H28N4O3/c1-33(2)19-24-10-7-17-34(24)23-14-12-22(13-15-23)31-28(20-8-5-4-6-9-20)27-25-16-11-21(30(36)37-3)18-26(25)32-29(27)35/h4-18,31H,19H2,1-3H3,(H,32,35)/b28-27-
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n/an/a>500n/an/an/an/an/an/a



Key Laboratory of Structure-Based Drug Design and Discovery (Shenyang Pharmaceutical University)

Curated by ChEMBL


Assay Description
Inhibition of recombinant human GST-tagged FGFR1 cytoplasmic domain (398 to 822 residues) expressed in baculovirus expression system preincubated for...

Bioorg Med Chem 25: 1778-1786 (2017)


Article DOI: 10.1016/j.bmc.2017.01.039
BindingDB Entry DOI: 10.7270/Q20P127V
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%