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4 similar compounds to monomer 50252542

Compile data set for download or QSAR
Wt: 449.5
BDBM50214853
Wt: 435.4
BDBM50214865
Wt: 449.5
BDBM50214867
Wt: 419.4
BDBM50320964

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 13 hits for monomerid = 50214853,50214865,50214867,50320964   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Vascular endothelial growth factor receptor 3


(Homo sapiens (Human))
BDBM50320964
PNG
(3-((4-(6-Methylpyridin-2-yl)-5-(quinolin-6-yl)-1H-...)
Show SMILES Cc1cccc(n1)-c1nc(Cc2cccc(c2)C(N)=O)[nH]c1-c1ccc2ncccc2c1
Show InChI InChI=1S/C26H21N5O/c1-16-5-2-9-22(29-16)25-24(19-10-11-21-18(15-19)8-4-12-28-21)30-23(31-25)14-17-6-3-7-20(13-17)26(27)32/h2-13,15H,14H2,1H3,(H2,27,32)(H,30,31)
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n/an/a 940n/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR3


Bioorg Med Chem 18: 4459-67 (2010)


Article DOI: 10.1016/j.bmc.2010.04.071
BindingDB Entry DOI: 10.7270/Q2RV0NWK
More data for this
Ligand-Target Pair
TGF-beta receptor type-1


(Homo sapiens (Human))
BDBM50214853
PNG
(3-((5-(6-ethylpyridin-2-yl)-4-(quinoxalin-6-yl)-1H...)
Show SMILES CCc1cccc(n1)-c1nc(CNc2cccc(c2)C(N)=O)[nH]c1-c1ccc2nccnc2c1
Show InChI InChI=1S/C26H23N7O/c1-2-18-6-4-8-21(31-18)25-24(16-9-10-20-22(14-16)29-12-11-28-20)32-23(33-25)15-30-19-7-3-5-17(13-19)26(27)34/h3-14,30H,2,15H2,1H3,(H2,27,34)(H,32,33)
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n/an/a 15n/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ALK5 phosphorylation expressed in Sf9 cells


J Med Chem 50: 3143-7 (2007)


Article DOI: 10.1021/jm070129k
BindingDB Entry DOI: 10.7270/Q2SQ903R
More data for this
Ligand-Target Pair
TGF-beta receptor type-1


(Homo sapiens (Human))
BDBM50214865
PNG
(4-((5-(6-methylpyridin-2-yl)-4-(quinoxalin-6-yl)-1...)
Show SMILES Cc1cccc(n1)-c1nc(CNc2ccc(cc2)C(N)=O)[nH]c1-c1ccc2nccnc2c1
Show InChI InChI=1S/C25H21N7O/c1-15-3-2-4-20(30-15)24-23(17-7-10-19-21(13-17)28-12-11-27-19)31-22(32-24)14-29-18-8-5-16(6-9-18)25(26)33/h2-13,29H,14H2,1H3,(H2,26,33)(H,31,32)
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n/an/a 75n/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ALK5 phosphorylation expressed in Sf9 cells


J Med Chem 50: 3143-7 (2007)


Article DOI: 10.1021/jm070129k
BindingDB Entry DOI: 10.7270/Q2SQ903R
More data for this
Ligand-Target Pair
TGF-beta receptor type-1


(Homo sapiens (Human))
BDBM50214867
PNG
(4-((5-(6-ethylpyridin-2-yl)-4-(quinoxalin-6-yl)-1H...)
Show SMILES CCc1cccc(n1)-c1nc(CNc2ccc(cc2)C(N)=O)[nH]c1-c1ccc2nccnc2c1
Show InChI InChI=1S/C26H23N7O/c1-2-18-4-3-5-21(31-18)25-24(17-8-11-20-22(14-17)29-13-12-28-20)32-23(33-25)15-30-19-9-6-16(7-10-19)26(27)34/h3-14,30H,2,15H2,1H3,(H2,27,34)(H,32,33)
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n/an/a 92n/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant ALK5 phosphorylation expressed in Sf9 cells


J Med Chem 50: 3143-7 (2007)


Article DOI: 10.1021/jm070129k
BindingDB Entry DOI: 10.7270/Q2SQ903R
More data for this
Ligand-Target Pair
TGF-beta receptor type-1


(Homo sapiens (Human))
BDBM50214865
PNG
(4-((5-(6-methylpyridin-2-yl)-4-(quinoxalin-6-yl)-1...)
Show SMILES Cc1cccc(n1)-c1nc(CNc2ccc(cc2)C(N)=O)[nH]c1-c1ccc2nccnc2c1
Show InChI InChI=1S/C25H21N7O/c1-15-3-2-4-20(30-15)24-23(17-7-10-19-21(13-17)28-12-11-27-19)31-22(32-24)14-29-18-8-5-16(6-9-18)25(26)33/h2-13,29H,14H2,1H3,(H2,26,33)(H,31,32)
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n/an/a 75n/an/an/an/an/an/a



Northeastern Ohio Universities Colleges of Medicine and Pharmacy

Curated by ChEMBL


Assay Description
Antagonistic activity at TGFBR1


Bioorg Med Chem Lett 20: 1918-23 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.140
BindingDB Entry DOI: 10.7270/Q2X63N3D
More data for this
Ligand-Target Pair
TGF-beta receptor type-1


(Homo sapiens (Human))
BDBM50214853
PNG
(3-((5-(6-ethylpyridin-2-yl)-4-(quinoxalin-6-yl)-1H...)
Show SMILES CCc1cccc(n1)-c1nc(CNc2cccc(c2)C(N)=O)[nH]c1-c1ccc2nccnc2c1
Show InChI InChI=1S/C26H23N7O/c1-2-18-6-4-8-21(31-18)25-24(16-9-10-20-22(14-16)29-12-11-28-20)32-23(33-25)15-30-19-7-3-5-17(13-19)26(27)34/h3-14,30H,2,15H2,1H3,(H2,27,34)(H,32,33)
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n/an/a 15n/an/an/an/an/an/a



Northeastern Ohio Universities Colleges of Medicine and Pharmacy

Curated by ChEMBL


Assay Description
Antagonistic activity at TGFBR1


Bioorg Med Chem Lett 20: 1918-23 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.140
BindingDB Entry DOI: 10.7270/Q2X63N3D
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha


(Homo sapiens (Human))
BDBM50320964
PNG
(3-((4-(6-Methylpyridin-2-yl)-5-(quinolin-6-yl)-1H-...)
Show SMILES Cc1cccc(n1)-c1nc(Cc2cccc(c2)C(N)=O)[nH]c1-c1ccc2ncccc2c1
Show InChI InChI=1S/C26H21N5O/c1-16-5-2-9-22(29-16)25-24(19-10-11-21-18(15-19)8-4-12-28-21)30-23(31-25)14-17-6-3-7-20(13-17)26(27)32/h2-13,15H,14H2,1H3,(H2,27,32)(H,30,31)
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n/an/a 3.00E+3n/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of PDGFRalpha


Bioorg Med Chem 18: 4459-67 (2010)


Article DOI: 10.1016/j.bmc.2010.04.071
BindingDB Entry DOI: 10.7270/Q2RV0NWK
More data for this
Ligand-Target Pair
TGF-beta receptor type-1


(Homo sapiens (Human))
BDBM50320964
PNG
(3-((4-(6-Methylpyridin-2-yl)-5-(quinolin-6-yl)-1H-...)
Show SMILES Cc1cccc(n1)-c1nc(Cc2cccc(c2)C(N)=O)[nH]c1-c1ccc2ncccc2c1
Show InChI InChI=1S/C26H21N5O/c1-16-5-2-9-22(29-16)25-24(19-10-11-21-18(15-19)8-4-12-28-21)30-23(31-25)14-17-6-3-7-20(13-17)26(27)32/h2-13,15H,14H2,1H3,(H2,27,32)(H,30,31)
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n/an/a 34n/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of human recombinant GST-fused ALK5 expressed in Sf9 cells


Bioorg Med Chem 18: 4459-67 (2010)


Article DOI: 10.1016/j.bmc.2010.04.071
BindingDB Entry DOI: 10.7270/Q2RV0NWK
More data for this
Ligand-Target Pair
TGF-beta receptor type-1


(Homo sapiens (Human))
BDBM50320964
PNG
(3-((4-(6-Methylpyridin-2-yl)-5-(quinolin-6-yl)-1H-...)
Show SMILES Cc1cccc(n1)-c1nc(Cc2cccc(c2)C(N)=O)[nH]c1-c1ccc2ncccc2c1
Show InChI InChI=1S/C26H21N5O/c1-16-5-2-9-22(29-16)25-24(19-10-11-21-18(15-19)8-4-12-28-21)30-23(31-25)14-17-6-3-7-20(13-17)26(27)32/h2-13,15H,14H2,1H3,(H2,27,32)(H,30,31)
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n/an/a 540n/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of p38alpha


Bioorg Med Chem 18: 4459-67 (2010)


Article DOI: 10.1016/j.bmc.2010.04.071
BindingDB Entry DOI: 10.7270/Q2RV0NWK
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase D1


(Homo sapiens (Human))
BDBM50320964
PNG
(3-((4-(6-Methylpyridin-2-yl)-5-(quinolin-6-yl)-1H-...)
Show SMILES Cc1cccc(n1)-c1nc(Cc2cccc(c2)C(N)=O)[nH]c1-c1ccc2ncccc2c1
Show InChI InChI=1S/C26H21N5O/c1-16-5-2-9-22(29-16)25-24(19-10-11-21-18(15-19)8-4-12-28-21)30-23(31-25)14-17-6-3-7-20(13-17)26(27)32/h2-13,15H,14H2,1H3,(H2,27,32)(H,30,31)
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n/an/a 650n/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of PKCmu


Bioorg Med Chem 18: 4459-67 (2010)


Article DOI: 10.1016/j.bmc.2010.04.071
BindingDB Entry DOI: 10.7270/Q2RV0NWK
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 1


(Homo sapiens (Human))
BDBM50320964
PNG
(3-((4-(6-Methylpyridin-2-yl)-5-(quinolin-6-yl)-1H-...)
Show SMILES Cc1cccc(n1)-c1nc(Cc2cccc(c2)C(N)=O)[nH]c1-c1ccc2ncccc2c1
Show InChI InChI=1S/C26H21N5O/c1-16-5-2-9-22(29-16)25-24(19-10-11-21-18(15-19)8-4-12-28-21)30-23(31-25)14-17-6-3-7-20(13-17)26(27)32/h2-13,15H,14H2,1H3,(H2,27,32)(H,30,31)
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n/an/a 2.10E+3n/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR1


Bioorg Med Chem 18: 4459-67 (2010)


Article DOI: 10.1016/j.bmc.2010.04.071
BindingDB Entry DOI: 10.7270/Q2RV0NWK
More data for this
Ligand-Target Pair
Vascular endothelial growth factor receptor 2


(Homo sapiens (Human))
BDBM50320964
PNG
(3-((4-(6-Methylpyridin-2-yl)-5-(quinolin-6-yl)-1H-...)
Show SMILES Cc1cccc(n1)-c1nc(Cc2cccc(c2)C(N)=O)[nH]c1-c1ccc2ncccc2c1
Show InChI InChI=1S/C26H21N5O/c1-16-5-2-9-22(29-16)25-24(19-10-11-21-18(15-19)8-4-12-28-21)30-23(31-25)14-17-6-3-7-20(13-17)26(27)32/h2-13,15H,14H2,1H3,(H2,27,32)(H,30,31)
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n/an/a 2.20E+3n/an/an/an/an/an/a



Ewha Womans University

Curated by ChEMBL


Assay Description
Inhibition of VEGFR2


Bioorg Med Chem 18: 4459-67 (2010)


Article DOI: 10.1016/j.bmc.2010.04.071
BindingDB Entry DOI: 10.7270/Q2RV0NWK
More data for this
Ligand-Target Pair
TGF-beta receptor type-1


(Homo sapiens (Human))
BDBM50214867
PNG
(4-((5-(6-ethylpyridin-2-yl)-4-(quinoxalin-6-yl)-1H...)
Show SMILES CCc1cccc(n1)-c1nc(CNc2ccc(cc2)C(N)=O)[nH]c1-c1ccc2nccnc2c1
Show InChI InChI=1S/C26H23N7O/c1-2-18-4-3-5-21(31-18)25-24(17-8-11-20-22(14-17)29-13-12-28-20)32-23(33-25)15-30-19-9-6-16(7-10-19)26(27)34/h3-14,30H,2,15H2,1H3,(H2,27,34)(H,32,33)
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n/an/a 92n/an/an/an/an/an/a



Northeastern Ohio Universities Colleges of Medicine and Pharmacy

Curated by ChEMBL


Assay Description
Antagonistic activity at TGFBR1


Bioorg Med Chem Lett 20: 1918-23 (2010)


Article DOI: 10.1016/j.bmcl.2010.01.140
BindingDB Entry DOI: 10.7270/Q2X63N3D
More data for this
Ligand-Target Pair