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Compile Data Set for Download or QSAR

Found 242 hits with Last Name = 'emeigh' and Initial = 'j'   
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
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302163
PNG
(3-amino-6-(4-aminopiperidin-1-yl)-4-propylthieno[2...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCC(N)CC1
Show InChI InChI=1S/C16H23N5OS/c1-2-3-9-8-11(21-6-4-10(17)5-7-21)20-16-12(9)13(18)14(23-16)15(19)22/h8,10H,2-7,17-18H2,1H3,(H2,19,22)
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n/an/a 41n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302174
PNG
(3-amino-6-(4-hydroxy-3,3-dimethylpiperidin-1-yl)-4...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCC(O)C(C)(C)C1
Show InChI InChI=1S/C18H26N4O2S/c1-4-5-10-8-12(22-7-6-11(23)18(2,3)9-22)21-17-13(10)14(19)15(25-17)16(20)24/h8,11,23H,4-7,9,19H2,1-3H3,(H2,20,24)
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n/an/a 42n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302169
PNG
(3-amino-6-(1,4-diazepan-1-yl)-4-propylthieno[2,3-b...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCCNCC1
Show InChI InChI=1S/C16H23N5OS/c1-2-4-10-9-11(21-7-3-5-19-6-8-21)20-16-12(10)13(17)14(23-16)15(18)22/h9,19H,2-8,17H2,1H3,(H2,18,22)
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n/an/a 72n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit alpha


(Homo sapiens (Human))
BDBM50302163
PNG
(3-amino-6-(4-aminopiperidin-1-yl)-4-propylthieno[2...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCC(N)CC1
Show InChI InChI=1S/C16H23N5OS/c1-2-3-9-8-11(21-6-4-10(17)5-7-21)20-16-12(9)13(18)14(23-16)15(19)22/h8,10H,2-7,17-18H2,1H3,(H2,19,22)
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n/an/a 90n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of IKKalpha


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302175
PNG
(3-amino-6-(4-(methylsulfonamido)piperidin-1-yl)-4-...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCC(CC1)NS(C)(=O)=O
Show InChI InChI=1S/C17H25N5O3S2/c1-3-4-10-9-12(20-17-13(10)14(18)15(26-17)16(19)23)22-7-5-11(6-8-22)21-27(2,24)25/h9,11,21H,3-8,18H2,1-2H3,(H2,19,23)
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n/an/a 98n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302164
PNG
(3-amino-6-(piperazin-1-yl)-4-propylthieno[2,3-b]py...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCNCC1
Show InChI InChI=1S/C15H21N5OS/c1-2-3-9-8-10(20-6-4-18-5-7-20)19-15-11(9)12(16)13(22-15)14(17)21/h8,18H,2-7,16H2,1H3,(H2,17,21)
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n/an/a 120n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302182
PNG
(3-amino-6-(4-(methylamino)piperidin-1-yl)-4-propyl...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCC(CC1)NC
Show InChI InChI=1S/C17H25N5OS/c1-3-4-10-9-12(22-7-5-11(20-2)6-8-22)21-17-13(10)14(18)15(24-17)16(19)23/h9,11,20H,3-8,18H2,1-2H3,(H2,19,23)
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n/an/a 120n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302167
PNG
(3-amino-6-(3-oxo-1,4-diazepan-1-yl)-4-propylthieno...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCCNC(=O)C1
Show InChI InChI=1S/C16H21N5O2S/c1-2-4-9-7-10(21-6-3-5-19-11(22)8-21)20-16-12(9)13(17)14(24-16)15(18)23/h7H,2-6,8,17H2,1H3,(H2,18,23)(H,19,22)
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n/an/a 140n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302177
PNG
(3-amino-6-(4-carbamoylpiperazin-1-yl)-4-propylthie...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCN(CC1)C(N)=O
Show InChI InChI=1S/C16H22N6O2S/c1-2-3-9-8-10(21-4-6-22(7-5-21)16(19)24)20-15-11(9)12(17)13(25-15)14(18)23/h8H,2-7,17H2,1H3,(H2,18,23)(H2,19,24)
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n/an/a 150n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302174
PNG
(3-amino-6-(4-hydroxy-3,3-dimethylpiperidin-1-yl)-4...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCC(O)C(C)(C)C1
Show InChI InChI=1S/C18H26N4O2S/c1-4-5-10-8-12(22-7-6-11(23)18(2,3)9-22)21-17-13(10)14(19)15(25-17)16(20)24/h8,11,23H,4-7,9,19H2,1-3H3,(H2,20,24)
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n/an/a 240n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302165
PNG
(3-amino-6-(4-hydroxypiperidin-1-yl)-4-propylthieno...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCC(O)CC1
Show InChI InChI=1S/C16H22N4O2S/c1-2-3-9-8-11(20-6-4-10(21)5-7-20)19-16-12(9)13(17)14(23-16)15(18)22/h8,10,21H,2-7,17H2,1H3,(H2,18,22)
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n/an/a 280n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Platelet-derived growth factor receptor alpha


(Homo sapiens (Human))
BDBM50302164
PNG
(3-amino-6-(piperazin-1-yl)-4-propylthieno[2,3-b]py...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCNCC1
Show InChI InChI=1S/C15H21N5OS/c1-2-3-9-8-10(20-6-4-18-5-7-20)19-15-11(9)12(16)13(22-15)14(17)21/h8,18H,2-7,16H2,1H3,(H2,17,21)
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n/an/a 300n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of PDGFRalpha


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302170
PNG
((R)-3-amino-6-(3-aminopyrrolidin-1-yl)-4-propylthi...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CC[C@@H](N)C1 |r|
Show InChI InChI=1S/C15H21N5OS/c1-2-3-8-6-10(20-5-4-9(16)7-20)19-15-11(8)12(17)13(22-15)14(18)21/h6,9H,2-5,7,16-17H2,1H3,(H2,18,21)/t9-/m1/s1
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n/an/a 500n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302180
PNG
(3-amino-6-(4-methylpiperazin-1-yl)-4-propylthieno[...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCN(C)CC1
Show InChI InChI=1S/C16H23N5OS/c1-3-4-10-9-11(21-7-5-20(2)6-8-21)19-16-12(10)13(17)14(23-16)15(18)22/h9H,3-8,17H2,1-2H3,(H2,18,22)
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n/an/a 520n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302166
PNG
(3-amino-6-(3-hydroxypiperidin-1-yl)-4-propylthieno...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCCC(O)C1
Show InChI InChI=1S/C16H22N4O2S/c1-2-4-9-7-11(20-6-3-5-10(21)8-20)19-16-12(9)13(17)14(23-16)15(18)22/h7,10,21H,2-6,8,17H2,1H3,(H2,18,22)
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n/an/a 570n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302171
PNG
((S)-3-amino-6-(3-aminopyrrolidin-1-yl)-4-propylthi...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CC[C@H](N)C1 |r|
Show InChI InChI=1S/C15H21N5OS/c1-2-3-8-6-10(20-5-4-9(16)7-20)19-15-11(8)12(17)13(22-15)14(18)21/h6,9H,2-5,7,16-17H2,1H3,(H2,18,21)/t9-/m0/s1
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n/an/a 590n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302168
PNG
(3-amino-6-(3-aminoazepan-1-yl)-4-propylthieno[2,3-...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCCCC(N)C1
Show InChI InChI=1S/C17H25N5OS/c1-2-5-10-8-12(22-7-4-3-6-11(18)9-22)21-17-13(10)14(19)15(24-17)16(20)23/h8,11H,2-7,9,18-19H2,1H3,(H2,20,23)
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n/an/a 630n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302183
PNG
(3-amino-6-(4-methoxypiperidin-1-yl)-4-propylthieno...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCC(CC1)OC
Show InChI InChI=1S/C17H24N4O2S/c1-3-4-10-9-12(21-7-5-11(23-2)6-8-21)20-17-13(10)14(18)15(24-17)16(19)22/h9,11H,3-8,18H2,1-2H3,(H2,19,22)
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n/an/a 680n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302181
PNG
(3-amino-6-(4-(dimethylamino)piperidin-1-yl)-4-prop...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCC(CC1)N(C)C
Show InChI InChI=1S/C18H27N5OS/c1-4-5-11-10-13(23-8-6-12(7-9-23)22(2)3)21-18-14(11)15(19)16(25-18)17(20)24/h10,12H,4-9,19H2,1-3H3,(H2,20,24)
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n/an/a 680n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302184
PNG
(3-amino-4-methyl-6-(piperazin-1-yl)thieno[2,3-b]py...)
Show SMILES Cc1cc(nc2sc(C(N)=O)c(N)c12)N1CCNCC1
Show InChI InChI=1S/C13H17N5OS/c1-7-6-8(18-4-2-16-3-5-18)17-13-9(7)10(14)11(20-13)12(15)19/h6,16H,2-5,14H2,1H3,(H2,15,19)
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n/an/a 680n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302185
PNG
(3-amino-6-(4-hydroxypiperidin-1-yl)-4-methylthieno...)
Show SMILES Cc1cc(nc2sc(C(N)=O)c(N)c12)N1CCC(O)CC1
Show InChI InChI=1S/C14H18N4O2S/c1-7-6-9(18-4-2-8(19)3-5-18)17-14-10(7)11(15)12(21-14)13(16)20/h6,8,19H,2-5,15H2,1H3,(H2,16,20)
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n/an/a 750n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50137196
PNG
(6-Phenyl-thieno[3,2-d]pyrimidin-4-ylamine | CHEMBL...)
Show SMILES Nc1ncnc2cc(sc12)-c1ccccc1
Show InChI InChI=1S/C12H9N3S/c13-12-11-9(14-7-15-12)6-10(16-11)8-4-2-1-3-5-8/h1-7H,(H2,13,14,15)
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n/an/a 970n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of IKK beta


J Med Chem 49: 2898-908 (2006)


Article DOI: 10.1021/jm0510979
BindingDB Entry DOI: 10.7270/Q2TQ614S
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302202
PNG
(3-amino-4-(furan-2-yl)-6-methylthieno[2,3-b]pyridi...)
Show SMILES Cc1cc(-c2ccco2)c2c(N)c(sc2n1)C(N)=O
Show InChI InChI=1S/C13H11N3O2S/c1-6-5-7(8-3-2-4-18-8)9-10(14)11(12(15)17)19-13(9)16-6/h2-5H,14H2,1H3,(H2,15,17)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50186619
PNG
(3-amino-5-phenyl-thiophene-2-carboxylic acid amide...)
Show SMILES NC(=O)c1sc(cc1N)-c1ccccc1
Show InChI InChI=1S/C11H10N2OS/c12-8-6-9(15-10(8)11(13)14)7-4-2-1-3-5-7/h1-6H,12H2,(H2,13,14)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of IKK beta


J Med Chem 49: 2898-908 (2006)


Article DOI: 10.1021/jm0510979
BindingDB Entry DOI: 10.7270/Q2TQ614S
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM26098
PNG
(3-amino-5-(thiophen-3-yl)thiophene-2-carboxamide |...)
Show SMILES NC(=O)c1sc(cc1N)-c1ccsc1
Show InChI InChI=1S/C9H8N2OS2/c10-6-3-7(5-1-2-13-4-5)14-8(6)9(11)12/h1-4H,10H2,(H2,11,12)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of IKK beta


J Med Chem 49: 2898-908 (2006)


Article DOI: 10.1021/jm0510979
BindingDB Entry DOI: 10.7270/Q2TQ614S
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302178
PNG
(3-amino-6-(4-carbamoylpiperidin-1-yl)-4-propylthie...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCC(CC1)C(N)=O
Show InChI InChI=1S/C17H23N5O2S/c1-2-3-10-8-11(22-6-4-9(5-7-22)15(19)23)21-17-12(10)13(18)14(25-17)16(20)24/h8-9H,2-7,18H2,1H3,(H2,19,23)(H2,20,24)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302195
PNG
(3-amino-6-methyl-4-(4-(methylsulfonyl)phenyl)thien...)
Show SMILES Cc1cc(-c2ccc(cc2)S(C)(=O)=O)c2c(N)c(sc2n1)C(N)=O
Show InChI InChI=1S/C16H15N3O3S2/c1-8-7-11(9-3-5-10(6-4-9)24(2,21)22)12-13(17)14(15(18)20)23-16(12)19-8/h3-7H,17H2,1-2H3,(H2,18,20)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302208
PNG
(3-amino-6-methyl-4-propylthieno[2,3-b]pyridine-2-c...)
Show SMILES CCCc1cc(C)nc2sc(C(N)=O)c(N)c12
Show InChI InChI=1S/C12H15N3OS/c1-3-4-7-5-6(2)15-12-8(7)9(13)10(17-12)11(14)16/h5H,3-4,13H2,1-2H3,(H2,14,16)
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n/an/a 1.30E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50186653
PNG
(CHEMBL207238 | amino-4-(4-carbamoyl-phenoxymethyl)...)
Show SMILES Cc1cc(COc2ccc(cc2)C(N)=O)c2c(N)c(sc2n1)C(N)=O
Show InChI InChI=1S/C17H16N4O3S/c1-8-6-10(7-24-11-4-2-9(3-5-11)15(19)22)12-13(18)14(16(20)23)25-17(12)21-8/h2-6H,7,18H2,1H3,(H2,19,22)(H2,20,23)
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n/an/a 1.40E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of IKK beta


J Med Chem 49: 2898-908 (2006)


Article DOI: 10.1021/jm0510979
BindingDB Entry DOI: 10.7270/Q2TQ614S
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302173
PNG
((S)-3-amino-6-(3-hydroxypyrrolidin-1-yl)-4-propylt...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CC[C@H](O)C1 |r|
Show InChI InChI=1S/C15H20N4O2S/c1-2-3-8-6-10(19-5-4-9(20)7-19)18-15-11(8)12(16)13(22-15)14(17)21/h6,9,20H,2-5,7,16H2,1H3,(H2,17,21)/t9-/m0/s1
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n/an/a 1.45E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50186637
PNG
(3-(3-methyl-ureido)-5-phenyl-thiophene-2-carboxyli...)
Show SMILES CNC(=O)Nc1cc(sc1C(N)=O)-c1ccccc1
Show InChI InChI=1S/C13H13N3O2S/c1-15-13(18)16-9-7-10(19-11(9)12(14)17)8-5-3-2-4-6-8/h2-7H,1H3,(H2,14,17)(H2,15,16,18)
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n/an/a 1.60E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of IKK beta


J Med Chem 49: 2898-908 (2006)


Article DOI: 10.1021/jm0510979
BindingDB Entry DOI: 10.7270/Q2TQ614S
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50186655
PNG
(2-amino-5-phenylthiophene-3-carboxamide | CHEMBL38...)
Show SMILES NC(=O)c1cc(sc1N)-c1ccccc1
Show InChI InChI=1S/C11H10N2OS/c12-10(14)8-6-9(15-11(8)13)7-4-2-1-3-5-7/h1-6H,13H2,(H2,12,14)
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n/an/a 1.90E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of IKK beta


J Med Chem 49: 2898-908 (2006)


Article DOI: 10.1021/jm0510979
BindingDB Entry DOI: 10.7270/Q2TQ614S
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302172
PNG
((R)-3-amino-6-(3-hydroxypyrrolidin-1-yl)-4-propylt...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CC[C@@H](O)C1 |r|
Show InChI InChI=1S/C15H20N4O2S/c1-2-3-8-6-10(19-5-4-9(20)7-19)18-15-11(8)12(16)13(22-15)14(17)21/h6,9,20H,2-5,7,16H2,1H3,(H2,17,21)/t9-/m1/s1
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n/an/a 1.95E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302179
PNG
(3-amino-6-(3-oxopiperazin-1-yl)-4-propylthieno[2,3...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCNC(=O)C1
Show InChI InChI=1S/C15H19N5O2S/c1-2-3-8-6-9(20-5-4-18-10(21)7-20)19-15-11(8)12(16)13(23-15)14(17)22/h6H,2-5,7,16H2,1H3,(H2,17,22)(H,18,21)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302200
PNG
(3-amino-6-methyl-4-(thiophen-2-yl)thieno[2,3-b]pyr...)
Show SMILES Cc1cc(-c2cccs2)c2c(N)c(sc2n1)C(N)=O
Show InChI InChI=1S/C13H11N3OS2/c1-6-5-7(8-3-2-4-18-8)9-10(14)11(12(15)17)19-13(9)16-6/h2-5H,14H2,1H3,(H2,15,17)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302205
PNG
(3-amino-4-ethoxythieno[2,3-b]pyridine-2-carboxamid...)
Show SMILES CCOc1ccnc2sc(C(N)=O)c(N)c12
Show InChI InChI=1S/C10H11N3O2S/c1-2-15-5-3-4-13-10-6(5)7(11)8(16-10)9(12)14/h3-4H,2,11H2,1H3,(H2,12,14)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Cytochrome P450 3A


(Homo sapiens (Human))
BDBM50186618
PNG
(3-amino-5-(4-fluoro-phenyl)-thiophene-2-carboxylic...)
Show SMILES NC(=O)c1sc(cc1N)-c1ccc(F)cc1
Show InChI InChI=1S/C11H9FN2OS/c12-7-3-1-6(2-4-7)9-5-8(13)10(16-9)11(14)15/h1-5H,13H2,(H2,14,15)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of CYP3A4


J Med Chem 49: 2898-908 (2006)


Article DOI: 10.1021/jm0510979
BindingDB Entry DOI: 10.7270/Q2TQ614S
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302204
PNG
(3-amino-4-propoxythieno[2,3-b]pyridine-2-carboxami...)
Show SMILES CCCOc1ccnc2sc(C(N)=O)c(N)c12
Show InChI InChI=1S/C11H13N3O2S/c1-2-5-16-6-3-4-14-11-7(6)8(12)9(17-11)10(13)15/h3-4H,2,5,12H2,1H3,(H2,13,15)
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n/an/a 2.20E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50186624
PNG
(3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carbox...)
Show SMILES Cc1cc(C)c2c(N)c(sc2n1)C(N)=O
Show InChI InChI=1S/C10H11N3OS/c1-4-3-5(2)13-10-6(4)7(11)8(15-10)9(12)14/h3H,11H2,1-2H3,(H2,12,14)
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n/an/a 2.20E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of IKK beta


J Med Chem 49: 2898-908 (2006)


Article DOI: 10.1021/jm0510979
BindingDB Entry DOI: 10.7270/Q2TQ614S
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302186
PNG
(3-amino-6-(3-hydroxypiperidin-1-yl)-4-methylthieno...)
Show SMILES Cc1cc(nc2sc(C(N)=O)c(N)c12)N1CCCC(O)C1
Show InChI InChI=1S/C14H18N4O2S/c1-7-5-9(18-4-2-3-8(19)6-18)17-14-10(7)11(15)12(21-14)13(16)20/h5,8,19H,2-4,6,15H2,1H3,(H2,16,20)
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n/an/a 2.40E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302188
PNG
(3-amino-4-methyl-6-(piperidin-1-yl)thieno[2,3-b]py...)
Show SMILES Cc1cc(nc2sc(C(N)=O)c(N)c12)N1CCCCC1
Show InChI InChI=1S/C14H18N4OS/c1-8-7-9(18-5-3-2-4-6-18)17-14-10(8)11(15)12(20-14)13(16)19/h7H,2-6,15H2,1H3,(H2,16,19)
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n/an/a 2.40E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302207
PNG
(3-amino-4-isobutyl-6-methylthieno[2,3-b]pyridine-2...)
Show SMILES CC(C)Cc1cc(C)nc2sc(C(N)=O)c(N)c12
Show InChI InChI=1S/C13H17N3OS/c1-6(2)4-8-5-7(3)16-13-9(8)10(14)11(18-13)12(15)17/h5-6H,4,14H2,1-3H3,(H2,15,17)
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n/an/a 2.50E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302187
PNG
(3-amino-4-methyl-6-morpholinothieno[2,3-b]pyridine...)
Show SMILES Cc1cc(nc2sc(C(N)=O)c(N)c12)N1CCOCC1
Show InChI InChI=1S/C13H16N4O2S/c1-7-6-8(17-2-4-19-5-3-17)16-13-9(7)10(14)11(20-13)12(15)18/h6H,2-5,14H2,1H3,(H2,15,18)
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n/an/a 2.50E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50186660
PNG
(3-amino-6-butyl-4-methyl-thieno[2,3-b]pyridine-2-c...)
Show SMILES CCCCc1cc(C)c2c(N)c(sc2n1)C(N)=O
Show InChI InChI=1S/C13H17N3OS/c1-3-4-5-8-6-7(2)9-10(14)11(12(15)17)18-13(9)16-8/h6H,3-5,14H2,1-2H3,(H2,15,17)
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n/an/a 2.50E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of IKK beta


J Med Chem 49: 2898-908 (2006)


Article DOI: 10.1021/jm0510979
BindingDB Entry DOI: 10.7270/Q2TQ614S
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50186618
PNG
(3-amino-5-(4-fluoro-phenyl)-thiophene-2-carboxylic...)
Show SMILES NC(=O)c1sc(cc1N)-c1ccc(F)cc1
Show InChI InChI=1S/C11H9FN2OS/c12-7-3-1-6(2-4-7)9-5-8(13)10(16-9)11(14)15/h1-5H,13H2,(H2,14,15)
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n/an/a 2.60E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of IKK beta


J Med Chem 49: 2898-908 (2006)


Article DOI: 10.1021/jm0510979
BindingDB Entry DOI: 10.7270/Q2TQ614S
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50186624
PNG
(3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carbox...)
Show SMILES Cc1cc(C)c2c(N)c(sc2n1)C(N)=O
Show InChI InChI=1S/C10H11N3OS/c1-4-3-5(2)13-10-6(4)7(11)8(15-10)9(12)14/h3H,11H2,1-2H3,(H2,12,14)
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n/an/a 2.70E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit alpha


(Homo sapiens (Human))
BDBM50186624
PNG
(3-amino-4,6-dimethylthieno[2,3-b]pyridine-2-carbox...)
Show SMILES Cc1cc(C)c2c(N)c(sc2n1)C(N)=O
Show InChI InChI=1S/C10H11N3OS/c1-4-3-5(2)13-10-6(4)7(11)8(15-10)9(12)14/h3H,11H2,1-2H3,(H2,12,14)
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n/an/a 2.80E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of IKK alpha


J Med Chem 49: 2898-908 (2006)


Article DOI: 10.1021/jm0510979
BindingDB Entry DOI: 10.7270/Q2TQ614S
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50186614
PNG
(3-amino-5-(4-methoxyphenyl)thiophene-2-carboxamide...)
Show SMILES COc1ccc(cc1)-c1cc(N)c(s1)C(N)=O
Show InChI InChI=1S/C12H12N2O2S/c1-16-8-4-2-7(3-5-8)10-6-9(13)11(17-10)12(14)15/h2-6H,13H2,1H3,(H2,14,15)
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n/an/a 2.90E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of IKK beta


J Med Chem 49: 2898-908 (2006)


Article DOI: 10.1021/jm0510979
BindingDB Entry DOI: 10.7270/Q2TQ614S
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit beta


(Homo sapiens (Human))
BDBM50302190
PNG
(3-amino-6-(2-aminoethoxy)-4-methylthieno[2,3-b]pyr...)
Show SMILES Cc1cc(OCCN)nc2sc(C(N)=O)c(N)c12
Show InChI InChI=1S/C11H14N4O2S/c1-5-4-6(17-3-2-12)15-11-7(5)8(13)9(18-11)10(14)16/h4H,2-3,12-13H2,1H3,(H2,14,16)
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n/an/a 2.90E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of Flag epitope-tagged IKK-beta preincubated for 5 mins by scintillation proximity assay


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
Inhibitor of nuclear factor kappa-B kinase subunit alpha


(Homo sapiens (Human))
BDBM50302164
PNG
(3-amino-6-(piperazin-1-yl)-4-propylthieno[2,3-b]py...)
Show SMILES CCCc1cc(nc2sc(C(N)=O)c(N)c12)N1CCNCC1
Show InChI InChI=1S/C15H21N5OS/c1-2-3-9-8-10(20-6-4-18-5-7-20)19-15-11(9)12(16)13(22-15)14(17)21/h8,18H,2-7,16H2,1H3,(H2,17,21)
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n/an/a 3.40E+3n/an/an/an/an/an/a



Boehringer Ingelheim Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibition of IKKalpha


Bioorg Med Chem Lett 19: 5547-51 (2009)


Article DOI: 10.1016/j.bmcl.2009.08.054
BindingDB Entry DOI: 10.7270/Q22Z16G1
More data for this
Ligand-Target Pair
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