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PubMed code 16376078

Compile data set for download or QSAR
Found 10 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
Thrombopoietin receptor


(Homo sapiens (Human))
BDBM50179471
PNG
(5-[1-[2-(4'-tert-Butyl-2-hydroxy-biphenyl-3-yl)-1H...)
Show SMILES CC(C)(C)c1ccc(cc1)-c1cccc(-c2nc3ccc(C=C4SC(=S)NC4=O)cc3[nH]2)c1O |w:21.21|
Show InChI InChI=1S/C27H23N3O2S2/c1-27(2,3)17-10-8-16(9-11-17)18-5-4-6-19(23(18)31)24-28-20-12-7-15(13-21(20)29-24)14-22-25(32)30-26(33)34-22/h4-14,31H,1-3H3,(H,28,29)(H,30,32,33)
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n/an/an/an/a 1.00E+3n/an/an/an/a



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity as induced proliferation in Ba/F3-hTpoR murine lymphocyte expressing human TPOR


Bioorg Med Chem Lett 16: 1212-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.096
BindingDB Entry DOI: 10.7270/Q2V124BM
More data for this
Ligand-Target Pair
Thrombopoietin receptor


(Homo sapiens (Human))
BDBM50179475
PNG
(5-((2-(5-(4-tert-butylphenyl)furan-2-yl)-1H-benzo[...)
Show SMILES CC(C)(C)c1ccc(cc1)-c1ccc(o1)-c1nc2ccc(C=C3SC(=S)NC3=O)cc2[nH]1 |w:21.22|
Show InChI InChI=1S/C25H21N3O2S2/c1-25(2,3)16-7-5-15(6-8-16)19-10-11-20(30-19)22-26-17-9-4-14(12-18(17)27-22)13-21-23(29)28-24(31)32-21/h4-13H,1-3H3,(H,26,27)(H,28,29,31)
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n/an/an/an/a 720n/an/an/an/a



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity as induced proliferation in Ba/F3-hTpoR murine lymphocyte expressing human TPOR


Bioorg Med Chem Lett 16: 1212-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.096
BindingDB Entry DOI: 10.7270/Q2V124BM
More data for this
Ligand-Target Pair
Thrombopoietin receptor


(Homo sapiens (Human))
BDBM50179477
PNG
(5-[1-[2-(4'-tert-Butyl-biphenyl-3-yl)-1H-benzoimid...)
Show SMILES CC(C)(C)c1ccc(cc1)-c1cccc(c1)-c1nc2ccc(C=C3SC(=S)NC3=O)cc2[nH]1 |w:22.23|
Show InChI InChI=1S/C27H23N3OS2/c1-27(2,3)20-10-8-17(9-11-20)18-5-4-6-19(15-18)24-28-21-12-7-16(13-22(21)29-24)14-23-25(31)30-26(32)33-23/h4-15H,1-3H3,(H,28,29)(H,30,31,32)
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n/an/an/an/a 900n/an/an/an/a



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity as induced proliferation in Ba/F3-hTpoR murine lymphocyte expressing human TPOR


Bioorg Med Chem Lett 16: 1212-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.096
BindingDB Entry DOI: 10.7270/Q2V124BM
More data for this
Ligand-Target Pair
Thrombopoietin receptor


(Homo sapiens (Human))
BDBM50179472
PNG
(5-((2-(4-(3,4-dimethylphenyl)thiophen-2-yl)-1H-ben...)
Show SMILES Cc1ccc(cc1C)-c1csc(c1)-c1nc2ccc(C=C3SC(S)=NC3=O)cc2[nH]1 |w:19.20,c:25|
Show InChI InChI=1S/C23H17N3OS3/c1-12-3-5-15(7-13(12)2)16-10-19(29-11-16)21-24-17-6-4-14(8-18(17)25-21)9-20-22(27)26-23(28)30-20/h3-11H,1-2H3,(H,24,25)(H,26,27,28)
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n/an/an/an/a 780n/an/an/an/a



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity as induced proliferation in Ba/F3-hTpoR murine lymphocyte expressing human TPOR


Bioorg Med Chem Lett 16: 1212-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.096
BindingDB Entry DOI: 10.7270/Q2V124BM
More data for this
Ligand-Target Pair
Thrombopoietin receptor


(Homo sapiens (Human))
BDBM50179476
PNG
(5-((2-(5-(3,4-dimethylphenyl)thiophen-2-yl)-1H-ben...)
Show SMILES Cc1ccc(cc1C)-c1ccc(s1)-c1nc2ccc(C=C3SC(S)=NC3=O)cc2[nH]1 |w:19.20,c:25|
Show InChI InChI=1S/C23H17N3OS3/c1-12-3-5-15(9-13(12)2)18-7-8-19(29-18)21-24-16-6-4-14(10-17(16)25-21)11-20-22(27)26-23(28)30-20/h3-11H,1-2H3,(H,24,25)(H,26,27,28)
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n/an/an/an/a 1.75E+3n/an/an/an/a



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity as induced proliferation in Ba/F3-hTpoR murine lymphocyte expressing human TPOR


Bioorg Med Chem Lett 16: 1212-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.096
BindingDB Entry DOI: 10.7270/Q2V124BM
More data for this
Ligand-Target Pair
Thrombopoietin receptor


(Homo sapiens (Human))
BDBM50179473
PNG
(2-((2-(6-(4-tert-butylphenyl)pyridin-2-yl)-1H-benz...)
Show SMILES CC(C)(C)c1ccc(cc1)-c1cccc(n1)-c1nc2ccc(CC(C(O)=O)C(O)=O)cc2[nH]1
Show InChI InChI=1S/C26H25N3O4/c1-26(2,3)17-10-8-16(9-11-17)19-5-4-6-21(27-19)23-28-20-12-7-15(14-22(20)29-23)13-18(24(30)31)25(32)33/h4-12,14,18H,13H2,1-3H3,(H,28,29)(H,30,31)(H,32,33)
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n/an/an/an/a 1.00E+4n/an/an/an/a



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity as induced proliferation in Ba/F3-hTpoR murine lymphocyte expressing human TPOR


Bioorg Med Chem Lett 16: 1212-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.096
BindingDB Entry DOI: 10.7270/Q2V124BM
More data for this
Ligand-Target Pair
Thrombopoietin receptor


(Homo sapiens (Human))
BDBM50179470
PNG
(5-((2-(6-(3,4-dichlorophenyl)pyridin-2-yl)-1H-benz...)
Show SMILES SC1=NC(=O)C(S1)=Cc1ccc2nc([nH]c2c1)-c1cccc(n1)-c1ccc(Cl)c(Cl)c1 |w:7.8,t:1|
Show InChI InChI=1S/C22H12Cl2N4OS2/c23-13-6-5-12(10-14(13)24)15-2-1-3-17(25-15)20-26-16-7-4-11(8-18(16)27-20)9-19-21(29)28-22(30)31-19/h1-10H,(H,26,27)(H,28,29,30)
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n/an/an/an/a 1.00E+3n/an/an/an/a



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity as induced proliferation in Ba/F3-hTpoR murine lymphocyte expressing human TPOR


Bioorg Med Chem Lett 16: 1212-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.096
BindingDB Entry DOI: 10.7270/Q2V124BM
More data for this
Ligand-Target Pair
Thrombopoietin receptor


(Homo sapiens (Human))
BDBM50179474
PNG
(3-(2-(6-(4-tert-butylphenyl)pyridin-2-yl)-1H-benzo...)
Show SMILES CC(=Cc1ccc2nc([nH]c2c1)-c1cccc(n1)-c1ccc(cc1)C(C)(C)C)C(O)=O |w:2.2|
Show InChI InChI=1S/C26H25N3O2/c1-16(25(30)31)14-17-8-13-21-23(15-17)29-24(28-21)22-7-5-6-20(27-22)18-9-11-19(12-10-18)26(2,3)4/h5-15H,1-4H3,(H,28,29)(H,30,31)
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n/an/an/an/a 4.50E+3n/an/an/an/a



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity as induced proliferation in Ba/F3-hTpoR murine lymphocyte expressing human TPOR


Bioorg Med Chem Lett 16: 1212-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.096
BindingDB Entry DOI: 10.7270/Q2V124BM
More data for this
Ligand-Target Pair
Thrombopoietin receptor


(Homo sapiens (Human))
BDBM50179478
PNG
(5-((2-(6-(3,4-dimethylphenyl)pyridin-2-yl)-1H-benz...)
Show SMILES Cc1ccc(cc1C)-c1cccc(n1)-c1nc2ccc(C=C3SC(S)=NC3=O)cc2[nH]1 |w:20.21,c:26|
Show InChI InChI=1S/C24H18N4OS2/c1-13-6-8-16(10-14(13)2)17-4-3-5-19(25-17)22-26-18-9-7-15(11-20(18)27-22)12-21-23(29)28-24(30)31-21/h3-12H,1-2H3,(H,26,27)(H,28,29,30)
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n/an/an/an/a 1.60E+3n/an/an/an/a



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity as induced proliferation in Ba/F3-hTpoR murine lymphocyte expressing human TPOR


Bioorg Med Chem Lett 16: 1212-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.096
BindingDB Entry DOI: 10.7270/Q2V124BM
More data for this
Ligand-Target Pair
Thrombopoietin receptor


(Homo sapiens (Human))
BDBM50179469
PNG
(5-((2-(6-(4-tert-butylphenyl)pyridin-2-yl)-1H-benz...)
Show SMILES CC(C)(C)c1ccc(cc1)-c1cccc(n1)-c1nc2ccc(C=C3SC(S)=NC3=O)cc2[nH]1 |w:22.23,c:28|
Show InChI InChI=1S/C26H22N4OS2/c1-26(2,3)17-10-8-16(9-11-17)18-5-4-6-20(27-18)23-28-19-12-7-15(13-21(19)29-23)14-22-24(31)30-25(32)33-22/h4-14H,1-3H3,(H,28,29)(H,30,31,32)
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n/an/an/an/a 2.00E+3n/an/an/an/a



GlaxoSmithKline Pharmaceuticals

Curated by ChEMBL


Assay Description
Agonist activity as induced proliferation in Ba/F3-hTpoR murine lymphocyte expressing human TPOR


Bioorg Med Chem Lett 16: 1212-6 (2006)


Article DOI: 10.1016/j.bmcl.2005.11.096
BindingDB Entry DOI: 10.7270/Q2V124BM
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%