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PubMed code 23130626

Compile data set for download or QSAR
Found 46 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
TGF-beta receptor type I


(Homo sapiens)
BDBM21492
PNG
(4-[3-(pyridin-2-yl)-1H-pyrazol-4-yl]quinoline | CH...)
Show SMILES c1[nH]nc(c1-c1ccnc2ccccc12)-c1ccccn1
Show InChI InChI=1S/C17H12N4/c1-2-6-15-13(5-1)12(8-10-19-15)14-11-20-21-17(14)16-7-3-4-9-18-16/h1-11H,(H,20,21)
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PubMed
n/an/a 40n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGFBR1


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
TGF-beta receptor type II


(Homo sapiens)
BDBM50110208
PNG
(4-(4-(benzo[d][1,3]dioxol-5-yl)-5-(pyridin-2-yl)-1...)
Show SMILES NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc2OCOc2c1)-c1ccccn1
Show InChI InChI=1S/C22H16N4O3/c23-21(27)13-4-6-14(7-5-13)22-25-19(20(26-22)16-3-1-2-10-24-16)15-8-9-17-18(11-15)29-12-28-17/h1-11H,12H2,(H2,23,27)(H,25,26)
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n/an/a 66n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type I


(Homo sapiens)
BDBM50110208
PNG
(4-(4-(benzo[d][1,3]dioxol-5-yl)-5-(pyridin-2-yl)-1...)
Show SMILES NC(=O)c1ccc(cc1)-c1nc(c([nH]1)-c1ccc2OCOc2c1)-c1ccccn1
Show InChI InChI=1S/C22H16N4O3/c23-21(27)13-4-6-14(7-5-13)22-25-19(20(26-22)16-3-1-2-10-24-16)15-8-9-17-18(11-15)29-12-28-17/h1-11H,12H2,(H2,23,27)(H,25,26)
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n/an/a 66n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGFBR1


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
TGF-beta receptor type II


(Homo sapiens)
BDBM50399830
PNG
(CHEMBL2180267)
Show SMILES CCCC1CC(=O)C2C(C(C(=O)OCC(C)C)=C(C)N=C2C1)c1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C28H39NO3/c1-8-9-19-14-22-26(23(30)15-19)25(20-10-12-21(13-11-20)28(5,6)7)24(18(4)29-22)27(31)32-16-17(2)3/h10-13,17,19,25-26H,8-9,14-16H2,1-7H3
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n/an/a 170n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399831
PNG
(CHEMBL2180266)
Show SMILES CCCC1CC(=O)C2C(C(C(=O)OCC)=C(C)N=C2C1)c1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C26H35NO3/c1-7-9-17-14-20-24(21(28)15-17)23(22(16(3)27-20)25(29)30-8-2)18-10-12-19(13-11-18)26(4,5)6/h10-13,17,23-24H,7-9,14-15H2,1-6H3
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n/an/a 170n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399828
PNG
(CHEMBL2180268)
Show SMILES CCCC1CC(=O)C2C(C(C(=O)OC)=C(C)N=C2C1)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C27H29NO3/c1-4-8-18-15-22-26(23(29)16-18)25(24(17(2)28-22)27(30)31-3)21-13-11-20(12-14-21)19-9-6-5-7-10-19/h5-7,9-14,18,25-26H,4,8,15-16H2,1-3H3
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n/an/a 400n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399829
PNG
(CHEMBL2180273)
Show SMILES CCOC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C27H29NO3/c1-5-31-26(30)23-17(2)28-21-15-27(3,4)16-22(29)25(21)24(23)20-13-11-19(12-14-20)18-9-7-6-8-10-18/h6-14,24-25H,5,15-16H2,1-4H3
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n/an/a 460n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399842
PNG
(CHEMBL2180281)
Show SMILES CC(C)COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C29H33NO3/c1-18(2)17-33-28(32)25-19(3)30-23-15-29(4,5)16-24(31)27(23)26(25)22-13-11-21(12-14-22)20-9-7-6-8-10-20/h6-14,18,26-27H,15-17H2,1-5H3
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n/an/a 530n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399828
PNG
(CHEMBL2180268)
Show SMILES CCCC1CC(=O)C2C(C(C(=O)OC)=C(C)N=C2C1)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C27H29NO3/c1-4-8-18-15-22-26(23(29)16-18)25(24(17(2)28-22)27(30)31-3)21-13-11-20(12-14-21)19-9-6-5-7-10-19/h5-7,9-14,18,25-26H,4,8,15-16H2,1-3H3
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n/an/a 530n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399861
PNG
(CHEMBL2180618)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C24H31NO3/c1-14-19(22(27)28-7)20(15-8-10-16(11-9-15)23(2,3)4)21-17(25-14)12-24(5,6)13-18(21)26/h8-11,20-21H,12-13H2,1-7H3
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n/an/a 560n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399860
PNG
(CHEMBL2180287)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)C1CCCCC1
Show InChI InChI=1S/C26H33NO3/c1-16-22(25(29)30-4)23(24-20(27-16)14-26(2,3)15-21(24)28)19-12-10-18(11-13-19)17-8-6-5-7-9-17/h10-13,17,23-24H,5-9,14-15H2,1-4H3
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n/an/a 590n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399834
PNG
(CHEMBL2180270)
Show SMILES COC(=O)C1=C(C)N=C2CC(CC(C)C)CC(=O)C2C1c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C28H31NO3/c1-17(2)14-19-15-23-27(24(30)16-19)26(25(18(3)29-23)28(31)32-4)22-12-10-21(11-13-22)20-8-6-5-7-9-20/h5-13,17,19,26-27H,14-16H2,1-4H3
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n/an/a 590n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399852
PNG
(CHEMBL2180612)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C27H26F3NO3/c1-15-22(25(33)34-4)23(24-20(31-15)13-26(2,3)14-21(24)32)18-7-5-16(6-8-18)17-9-11-19(12-10-17)27(28,29)30/h5-12,23-24H,13-14H2,1-4H3
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n/an/a 730n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399843
PNG
(CHEMBL2180280)
Show SMILES CC1=C(C(C2C(=O)CC(C)(C)CC2=N1)c1ccc(cc1)-c1ccccc1)C(=O)OCC(F)(F)F
Show InChI InChI=1S/C27H26F3NO3/c1-16-22(25(33)34-15-27(28,29)30)23(24-20(31-16)13-26(2,3)14-21(24)32)19-11-9-18(10-12-19)17-7-5-4-6-8-17/h4-12,23-24H,13-15H2,1-3H3
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n/an/a 760n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399836
PNG
(CHEMBL2177136)
Show SMILES CCC1CC(=O)C2C(C(C(=O)OC)=C(C)N=C2C1)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C26H27NO3/c1-4-17-14-21-25(22(28)15-17)24(23(16(2)27-21)26(29)30-3)20-12-10-19(11-13-20)18-8-6-5-7-9-18/h5-13,17,24-25H,4,14-15H2,1-3H3
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n/an/a 790n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399840
PNG
(CHEMBL2180283)
Show SMILES COc1ccc(COC(=O)C2=C(C)N=C3CC(C)(C)CC(=O)C3C2c2ccc(cc2)-c2ccccc2)cc1
Show InChI InChI=1S/C33H33NO4/c1-21-29(32(36)38-20-22-10-16-26(37-4)17-11-22)30(31-27(34-21)18-33(2,3)19-28(31)35)25-14-12-24(13-15-25)23-8-6-5-7-9-23/h5-17,30-31H,18-20H2,1-4H3
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n/an/a 830n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399838
PNG
(CHEMBL2180285)
Show SMILES CCCC1=C(C(C2C(=O)CC(C)(C)CC2=N1)c1ccc(cc1)-c1ccccc1)C(=O)OCC
Show InChI InChI=1S/C29H33NO3/c1-5-10-22-27(28(32)33-6-2)25(26-23(30-22)17-29(3,4)18-24(26)31)21-15-13-20(14-16-21)19-11-8-7-9-12-19/h7-9,11-16,25-26H,5-6,10,17-18H2,1-4H3
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n/an/a 830n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399829
PNG
(CHEMBL2180273)
Show SMILES CCOC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C27H29NO3/c1-5-31-26(30)23-17(2)28-21-15-27(3,4)16-22(29)25(21)24(23)20-13-11-19(12-14-20)18-9-7-6-8-10-18/h6-14,24-25H,5,15-16H2,1-4H3
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n/an/a 850n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399853
PNG
(CHEMBL2180611)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-c1ccc(C)cc1
Show InChI InChI=1S/C27H29NO3/c1-16-6-8-18(9-7-16)19-10-12-20(13-11-19)24-23(26(30)31-5)17(2)28-21-14-27(3,4)15-22(29)25(21)24/h6-13,24-25H,14-15H2,1-5H3
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n/an/a 860n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399850
PNG
(CHEMBL2180614)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-c1ccccc1C
Show InChI InChI=1S/C27H29NO3/c1-16-8-6-7-9-20(16)18-10-12-19(13-11-18)24-23(26(30)31-5)17(2)28-21-14-27(3,4)15-22(29)25(21)24/h6-13,24-25H,14-15H2,1-5H3
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n/an/a 890n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399835
PNG
(CHEMBL2180269)
Show SMILES COC(=O)C1=C(C)N=C2CC(CC(=O)C2C1c1ccc(cc1)-c1ccccc1)C(C)C
Show InChI InChI=1S/C27H29NO3/c1-16(2)21-14-22-26(23(29)15-21)25(24(17(3)28-22)27(30)31-4)20-12-10-19(11-13-20)18-8-6-5-7-9-18/h5-13,16,21,25-26H,14-15H2,1-4H3
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n/an/a 940n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399854
PNG
(CHEMBL2180610)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-c1ccc(cc1)C(=O)OC
Show InChI InChI=1S/C28H29NO5/c1-16-23(27(32)34-5)24(25-21(29-16)14-28(2,3)15-22(25)30)19-10-6-17(7-11-19)18-8-12-20(13-9-18)26(31)33-4/h6-13,24-25H,14-15H2,1-5H3
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n/an/a 1.35E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399841
PNG
(CHEMBL2180282)
Show SMILES CC(C)CCOC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C30H35NO3/c1-19(2)15-16-34-29(33)26-20(3)31-24-17-30(4,5)18-25(32)28(24)27(26)23-13-11-22(12-14-23)21-9-7-6-8-10-21/h6-14,19,27-28H,15-18H2,1-5H3
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n/an/a 1.46E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399859
PNG
(CHEMBL2180288)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C26H27NO3/c1-16-22(25(29)30-4)23(24-20(27-16)14-26(2,3)15-21(24)28)19-12-10-18(11-13-19)17-8-6-5-7-9-17/h5-13,23-24H,14-15H2,1-4H3
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n/an/a 1.49E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399851
PNG
(CHEMBL2180613)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-c1cccc(Cl)c1
Show InChI InChI=1S/C26H26ClNO3/c1-15-22(25(30)31-4)23(24-20(28-15)13-26(2,3)14-21(24)29)17-10-8-16(9-11-17)18-6-5-7-19(27)12-18/h5-12,23-24H,13-14H2,1-4H3
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n/an/a 1.52E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399855
PNG
(CHEMBL2180609)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(c(F)c1)-c1ccccc1
Show InChI InChI=1S/C26H26FNO3/c1-15-22(25(30)31-4)23(24-20(28-15)13-26(2,3)14-21(24)29)17-10-11-18(19(27)12-17)16-8-6-5-7-9-16/h5-12,23-24H,13-14H2,1-4H3
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n/an/a 1.84E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399833
PNG
(CHEMBL2180271)
Show SMILES COC(=O)C1C(C2=C(CC(CC2=O)c2ccccc2)N=C1C)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C30H27NO3/c1-19-27(30(33)34-2)28(23-15-13-22(14-16-23)20-9-5-3-6-10-20)29-25(31-19)17-24(18-26(29)32)21-11-7-4-8-12-21/h3-16,24,27-28H,17-18H2,1-2H3
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n/an/a 1.92E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399827
PNG
(CHEMBL2180274)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1cccc(c1)-c1ccc2[nH]ccc2c1
Show InChI InChI=1S/C28H28N2O3/c1-16-24(27(32)33-4)25(26-22(30-16)14-28(2,3)15-23(26)31)20-7-5-6-17(13-20)18-8-9-21-19(12-18)10-11-29-21/h5-13,25-26,29H,14-15H2,1-4H3
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n/an/a 2.03E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399849
PNG
(CHEMBL2180615)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-c1ccccc1F
Show InChI InChI=1S/C26H26FNO3/c1-15-22(25(30)31-4)23(24-20(28-15)13-26(2,3)14-21(24)29)17-11-9-16(10-12-17)18-7-5-6-8-19(18)27/h5-12,23-24H,13-14H2,1-4H3
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n/an/a 2.06E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399827
PNG
(CHEMBL2180274)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1cccc(c1)-c1ccc2[nH]ccc2c1
Show InChI InChI=1S/C28H28N2O3/c1-16-24(27(32)33-4)25(26-22(30-16)14-28(2,3)15-23(26)31)20-7-5-6-17(13-20)18-8-9-21-19(12-18)10-11-29-21/h5-13,25-26,29H,14-15H2,1-4H3
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n/an/a 2.64E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399837
PNG
(CHEMBL2180286)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)CC(=O)C2C1c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C25H25NO3/c1-15-13-20-24(21(27)14-15)23(22(16(2)26-20)25(28)29-3)19-11-9-18(10-12-19)17-7-5-4-6-8-17/h4-12,15,23-24H,13-14H2,1-3H3
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n/an/a 2.73E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399857
PNG
(CHEMBL2180290)
Show SMILES CCOC(=O)C1=C(CC)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-c1ccccn1
Show InChI InChI=1S/C27H30N2O3/c1-5-19-25(26(31)32-6-2)23(24-21(29-19)15-27(3,4)16-22(24)30)18-12-10-17(11-13-18)20-9-7-8-14-28-20/h7-14,23-24H,5-6,15-16H2,1-4H3
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n/an/a 3.57E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399832
PNG
(CHEMBL2180272)
Show SMILES COC(=O)C1C(C2=C(CC(CC2=O)c2ccc(cc2)N(C)C)N=C1C)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C32H32N2O3/c1-20-29(32(36)37-4)30(24-12-10-22(11-13-24)21-8-6-5-7-9-21)31-27(33-20)18-25(19-28(31)35)23-14-16-26(17-15-23)34(2)3/h5-17,25,29-30H,18-19H2,1-4H3
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n/an/a 3.97E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399856
PNG
(CHEMBL2180608)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-c1ccc2[nH]ccc2c1
Show InChI InChI=1S/C28H28N2O3/c1-16-24(27(32)33-4)25(26-22(30-16)14-28(2,3)15-23(26)31)18-7-5-17(6-8-18)19-9-10-21-20(13-19)11-12-29-21/h5-13,25-26,29H,14-15H2,1-4H3
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n/an/a 4.05E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399839
PNG
(CHEMBL2180284)
Show SMILES COc1ccc(CNC(=O)C2=C(C)N=C3CC(C)(C)CC(=O)C3C2c2ccc(cc2)-c2ccccc2)cc1
Show InChI InChI=1S/C33H34N2O3/c1-21-29(32(37)34-20-22-10-16-26(38-4)17-11-22)30(31-27(35-21)18-33(2,3)19-28(31)36)25-14-12-24(13-15-25)23-8-6-5-7-9-23/h5-17,30-31H,18-20H2,1-4H3,(H,34,37)
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n/an/a 4.06E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399828
PNG
(CHEMBL2180268)
Show SMILES CCCC1CC(=O)C2C(C(C(=O)OC)=C(C)N=C2C1)c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C27H29NO3/c1-4-8-18-15-22-26(23(29)16-18)25(24(17(2)28-22)27(30)31-3)21-13-11-20(12-14-21)19-9-6-5-7-10-19/h5-7,9-14,18,25-26H,4,8,15-16H2,1-3H3
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n/an/a 4.06E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399827
PNG
(CHEMBL2180274)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1cccc(c1)-c1ccc2[nH]ccc2c1
Show InChI InChI=1S/C28H28N2O3/c1-16-24(27(32)33-4)25(26-22(30-16)14-28(2,3)15-23(26)31)20-7-5-6-17(13-20)18-8-9-21-19(12-18)10-11-29-21/h5-13,25-26,29H,14-15H2,1-4H3
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n/an/a 4.45E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399829
PNG
(CHEMBL2180273)
Show SMILES CCOC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C27H29NO3/c1-5-31-26(30)23-17(2)28-21-15-27(3,4)16-22(29)25(21)24(23)20-13-11-19(12-14-20)18-9-7-6-8-10-18/h6-14,24-25H,5,15-16H2,1-4H3
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n/an/a 6.90E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399858
PNG
(CHEMBL2180289)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(cc1)-n1cccn1
Show InChI InChI=1S/C23H25N3O3/c1-14-19(22(28)29-4)20(21-17(25-14)12-23(2,3)13-18(21)27)15-6-8-16(9-7-15)26-11-5-10-24-26/h5-11,20-21H,12-13H2,1-4H3
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n/an/a 8.80E+3n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399845
PNG
(CHEMBL2180278)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1cccc(c1)-c1cccnc1
Show InChI InChI=1S/C25H26N2O3/c1-15-21(24(29)30-4)22(23-19(27-15)12-25(2,3)13-20(23)28)17-8-5-7-16(11-17)18-9-6-10-26-14-18/h5-11,14,22-23H,12-13H2,1-4H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399846
PNG
(CHEMBL2180277)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1cccc(c1)-c1cccc(Cl)c1
Show InChI InChI=1S/C26H26ClNO3/c1-15-22(25(30)31-4)23(24-20(28-15)13-26(2,3)14-21(24)29)18-9-5-7-16(11-18)17-8-6-10-19(27)12-17/h5-12,23-24H,13-14H2,1-4H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399862
PNG
(CHEMBL2180617)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccccc1
Show InChI InChI=1S/C20H23NO3/c1-12-16(19(23)24-4)17(13-8-6-5-7-9-13)18-14(21-12)10-20(2,3)11-15(18)22/h5-9,17-18H,10-11H2,1-4H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399844
PNG
(CHEMBL2180279)
Show SMILES CC1=C(C(C2C(=O)CC(C)(C)CC2=N1)c1ccc(cc1)-c1ccccc1)C(O)=O
Show InChI InChI=1S/C25H25NO3/c1-15-21(24(28)29)22(23-19(26-15)13-25(2,3)14-20(23)27)18-11-9-17(10-12-18)16-7-5-4-6-8-16/h4-12,22-23H,13-14H2,1-3H3,(H,28,29)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399848
PNG
(CHEMBL2180275)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1cccc(c1)-c1ccccc1
Show InChI InChI=1S/C26H27NO3/c1-16-22(25(29)30-4)23(24-20(27-16)14-26(2,3)15-21(24)28)19-12-8-11-18(13-19)17-9-6-5-7-10-17/h5-13,23-24H,14-15H2,1-4H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399863
PNG
(CHEMBL2180616)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1ccc(F)cc1
Show InChI InChI=1S/C20H22FNO3/c1-11-16(19(24)25-4)17(12-5-7-13(21)8-6-12)18-14(22-11)9-20(2,3)10-15(18)23/h5-8,17-18H,9-10H2,1-4H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
TGF-beta receptor type II


(Homo sapiens)
BDBM50399847
PNG
(CHEMBL2180276)
Show SMILES COC(=O)C1=C(C)N=C2CC(C)(C)CC(=O)C2C1c1cccc(c1)-c1ccc(OC)cc1
Show InChI InChI=1S/C27H29NO4/c1-16-23(26(30)32-5)24(25-21(28-16)14-27(2,3)15-22(25)29)19-8-6-7-18(13-19)17-9-11-20(31-4)12-10-17/h6-13,24-25H,14-15H2,1-5H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Inhibition of TGBR2 signaling in human HEK293T cells assessed as inhibition of SMAD activation after 2 to 22 hrs by dual Luciferase Assay


J Med Chem 55: 9946-57 (2012)


Article DOI: 10.1021/jm301144g
BindingDB Entry DOI: 10.7270/Q2DF6SCJ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%