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Compile Data Set for Download or QSAR

Found 182 hits of ec50 data for polymerid = 50000606,50001237,50001880,50002487,50002529   
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
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM557812
PNG
(US11365181, Compound 03058)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCOc2cc(F)ccc2C1
PDB

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n/an/an/an/a 8n/an/an/an/a


TBA

Assay Description
Cell preparation: CHO-KCNQ2 cells were cultured in a 175 cm2 culture flask, and when the cells was grown to a density of 60-80%, the culture medium w...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2BC42RQ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50463341
PNG
(CHEMBL4238783)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCc2ccsc2C1
Show InChI InChI=1S/C21H28N2OS/c1-14-10-17(23-8-6-16-7-9-25-18(16)13-23)11-15(2)20(14)22-19(24)12-21(3,4)5/h7,9-11H,6,8,12-13H2,1-5H3,(H,22,24)
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n/an/an/an/a 20n/an/an/an/a



Nanjing University of Technology

Curated by ChEMBL


Assay Description
Channel opening activity at KCNQ2 (unknown origin) expressed in CHO cells after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 3004-3008 (2018)


Article DOI: 10.1016/j.bmcl.2018.05.019
BindingDB Entry DOI: 10.7270/Q2H997WB
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 4


(Homo sapiens (Human))
BDBM50465773
PNG
(CHEMBL4277250)
Show SMILES OC[C@H](NC(=O)[C@H]1CC(F)(F)CC[C@@H]1c1ccccc1)c1cccc(c1)C(F)(F)F |r|
Show InChI InChI=1S/C22H22F5NO2/c23-21(24)10-9-17(14-5-2-1-3-6-14)18(12-21)20(30)28-19(13-29)15-7-4-8-16(11-15)22(25,26)27/h1-8,11,17-19,29H,9-10,12-13H2,(H,28,30)/t17-,18+,19+/m1/s1
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n/an/an/an/a 20n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Activation of human Kv7.4 by patch clamp method


Bioorg Med Chem Lett 28: 3793-3797 (2018)


Article DOI: 10.1016/j.bmcl.2018.09.036
BindingDB Entry DOI: 10.7270/Q28W3H0D
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50463349
PNG
(CHEMBL4250878)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCc2sccc2C1
Show InChI InChI=1S/C21H28N2OS/c1-14-10-17(23-8-6-18-16(13-23)7-9-25-18)11-15(2)20(14)22-19(24)12-21(3,4)5/h7,9-11H,6,8,12-13H2,1-5H3,(H,22,24)
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Nanjing University of Technology

Curated by ChEMBL


Assay Description
Channel opening activity at KCNQ2 (unknown origin) expressed in CHO cells after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 3004-3008 (2018)


Article DOI: 10.1016/j.bmcl.2018.05.019
BindingDB Entry DOI: 10.7270/Q2H997WB
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM557809
PNG
(US11365181, Compound 03043)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCCc2sc(Cl)cc2C1
PDB

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TBA

Assay Description
Cell preparation: CHO-KCNQ2 cells were cultured in a 175 cm2 culture flask, and when the cells was grown to a density of 60-80%, the culture medium w...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2BC42RQ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50463346
PNG
(CHEMBL4250403)
Show SMILES Cc1cc2CCN(Cc2s1)c1cc(C)c(NC(=O)CC(C)(C)C)c(C)c1
Show InChI InChI=1S/C22H30N2OS/c1-14-9-18(24-8-7-17-11-16(3)26-19(17)13-24)10-15(2)21(14)23-20(25)12-22(4,5)6/h9-11H,7-8,12-13H2,1-6H3,(H,23,25)
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n/an/an/an/a 30n/an/an/an/a



Nanjing University of Technology

Curated by ChEMBL


Assay Description
Channel opening activity at KCNQ2 (unknown origin) expressed in CHO cells after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 3004-3008 (2018)


Article DOI: 10.1016/j.bmcl.2018.05.019
BindingDB Entry DOI: 10.7270/Q2H997WB
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50463345
PNG
(CHEMBL4247074)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCn2cccc2C1
Show InChI InChI=1S/C21H29N3O/c1-15-11-18(24-10-9-23-8-6-7-17(23)14-24)12-16(2)20(15)22-19(25)13-21(3,4)5/h6-8,11-12H,9-10,13-14H2,1-5H3,(H,22,25)
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n/an/an/an/a 34n/an/an/an/a



Nanjing University of Technology

Curated by ChEMBL


Assay Description
Channel opening activity at KCNQ2 (unknown origin) expressed in CHO cells after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 3004-3008 (2018)


Article DOI: 10.1016/j.bmcl.2018.05.019
BindingDB Entry DOI: 10.7270/Q2H997WB
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50463342
PNG
(CHEMBL4247002)
Show SMILES Cc1ccc2N(CCCCc2c1)c1cc(C)c(NC(=O)CC(C)(C)C)c(C)c1
Show InChI InChI=1S/C25H34N2O/c1-17-10-11-22-20(13-17)9-7-8-12-27(22)21-14-18(2)24(19(3)15-21)26-23(28)16-25(4,5)6/h10-11,13-15H,7-9,12,16H2,1-6H3,(H,26,28)
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n/an/an/an/a 40n/an/an/an/a



Nanjing University of Technology

Curated by ChEMBL


Assay Description
Channel opening activity at KCNQ2 (unknown origin) expressed in CHO cells after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 3004-3008 (2018)


Article DOI: 10.1016/j.bmcl.2018.05.019
BindingDB Entry DOI: 10.7270/Q2H997WB
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM557815
PNG
(US11365181, Compound 03066)
Show SMILES Cc1ccc2N(CCOCc2c1)c1cc(C)c(NC(=O)CC(C)(C)C)c(C)c1
PDB

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n/an/an/an/a 49n/an/an/an/a


TBA

Assay Description
Cell preparation: CHO-KCNQ2 cells were cultured in a 175 cm2 culture flask, and when the cells was grown to a density of 60-80%, the culture medium w...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2BC42RQ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50592357
PNG
(CHEMBL5185685)
Show SMILES CCOC(=O)Nc1cc(F)c(NCc2ccc(cc2)C(F)(F)F)c(F)c1N
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128841
BindingDB Entry DOI: 10.7270/Q2571H05
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM557810
PNG
(US11365181, Compound 03044)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCCc2cc(Cl)sc2C1
PDB

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n/an/an/an/a 57n/an/an/an/a


TBA

Assay Description
Cell preparation: CHO-KCNQ2 cells were cultured in a 175 cm2 culture flask, and when the cells was grown to a density of 60-80%, the culture medium w...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2BC42RQ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM557818
PNG
(US11365181, Compound A (WO2014/048165 A1))
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCc2sc(Cl)cc2C1
PDB

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n/an/an/an/a 65n/an/an/an/a


TBA

Assay Description
Cell preparation: CHO-KCNQ2 cells were cultured in a 175 cm2 culture flask, and when the cells was grown to a density of 60-80%, the culture medium w...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2BC42RQ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM557807
PNG
(US11365181, Compound 03034)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCCCc2sccc12
PDB

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n/an/an/an/a 71n/an/an/an/a


TBA

Assay Description
Cell preparation: CHO-KCNQ2 cells were cultured in a 175 cm2 culture flask, and when the cells was grown to a density of 60-80%, the culture medium w...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2BC42RQ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50526877
PNG
(CHEMBL4545892)
Show SMILES CCCCCCC(=O)Nc1ccc2n(Cc3ccc(cc3)C(F)(F)F)ccc2c1
Show InChI InChI=1S/C23H25F3N2O/c1-2-3-4-5-6-22(29)27-20-11-12-21-18(15-20)13-14-28(21)16-17-7-9-19(10-8-17)23(24,25)26/h7-15H,2-6,16H2,1H3,(H,27,29)
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n/an/an/an/a 80n/an/an/an/a



University Federico II of Naples

Curated by ChEMBL


Assay Description
Activation of human Kv7.2 expressed in CHO cells assessed as increase in channel current amplitude by whole cell patch clamp electrophysiology assay


J Med Chem 63: 163-185 (2020)


Article DOI: 10.1021/acs.jmedchem.9b00796
BindingDB Entry DOI: 10.7270/Q2KW5KG2
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 4


(Homo sapiens (Human))
BDBM50526876
PNG
(CHEMBL4457044)
Show SMILES CC(C)(C)CC(=O)Nc1ccc2n(Cc3ccc(cc3)C(F)(F)F)ccc2c1
Show InChI InChI=1S/C22H23F3N2O/c1-21(2,3)13-20(28)26-18-8-9-19-16(12-18)10-11-27(19)14-15-4-6-17(7-5-15)22(23,24)25/h4-12H,13-14H2,1-3H3,(H,26,28)
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n/an/an/an/a 80n/an/an/an/a



University Federico II of Naples

Curated by ChEMBL


Assay Description
Activation of human Kv7.4 expressed in CHO cells assessed as increase in channel current amplitude by whole cell patch clamp electrophysiology assay


J Med Chem 63: 163-185 (2020)


Article DOI: 10.1021/acs.jmedchem.9b00796
BindingDB Entry DOI: 10.7270/Q2KW5KG2
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 4


(Homo sapiens (Human))
BDBM50592357
PNG
(CHEMBL5185685)
Show SMILES CCOC(=O)Nc1cc(F)c(NCc2ccc(cc2)C(F)(F)F)c(F)c1N
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128841
BindingDB Entry DOI: 10.7270/Q2571H05
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM557803
PNG
(US11365181, Compound 03026)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCCc2ccsc2C1
PDB

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n/an/an/an/a 88n/an/an/an/a


TBA

Assay Description
Cell preparation: CHO-KCNQ2 cells were cultured in a 175 cm2 culture flask, and when the cells was grown to a density of 60-80%, the culture medium w...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2BC42RQ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM557819
PNG
(US11365181, Compound B (WO2008/024398 A2))
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCc2cc(F)ccc2C1
PDB

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n/an/an/an/a 98n/an/an/an/a


TBA

Assay Description
Cell preparation: CHO-KCNQ2 cells were cultured in a 175 cm2 culture flask, and when the cells was grown to a density of 60-80%, the culture medium w...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2BC42RQ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 4


(Homo sapiens (Human))
BDBM50465774
PNG
(CHEMBL4287894)
Show SMILES OC[C@H](NC(=O)[C@H]1CC(F)(F)CC[C@@H]1c1ccccc1)c1cccc(Cl)c1 |r|
Show InChI InChI=1S/C21H22ClF2NO2/c22-16-8-4-7-15(11-16)19(13-26)25-20(27)18-12-21(23,24)10-9-17(18)14-5-2-1-3-6-14/h1-8,11,17-19,26H,9-10,12-13H2,(H,25,27)/t17-,18+,19+/m1/s1
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GlaxoSmithKline

Curated by ChEMBL


Assay Description
Activation of human Kv7.4 by patch clamp method


Bioorg Med Chem Lett 28: 3793-3797 (2018)


Article DOI: 10.1016/j.bmcl.2018.09.036
BindingDB Entry DOI: 10.7270/Q28W3H0D
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 4


(Homo sapiens (Human))
BDBM50526877
PNG
(CHEMBL4545892)
Show SMILES CCCCCCC(=O)Nc1ccc2n(Cc3ccc(cc3)C(F)(F)F)ccc2c1
Show InChI InChI=1S/C23H25F3N2O/c1-2-3-4-5-6-22(29)27-20-11-12-21-18(15-20)13-14-28(21)16-17-7-9-19(10-8-17)23(24,25)26/h7-15H,2-6,16H2,1H3,(H,27,29)
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University Federico II of Naples

Curated by ChEMBL


Assay Description
Activation of human Kv7.4 expressed in CHO cells assessed as increase in channel current amplitude by whole cell patch clamp electrophysiology assay


J Med Chem 63: 163-185 (2020)


Article DOI: 10.1021/acs.jmedchem.9b00796
BindingDB Entry DOI: 10.7270/Q2KW5KG2
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50463347
PNG
(CHEMBL4246596)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCc2sc(cc2C1)C(F)(F)F
Show InChI InChI=1S/C22H27F3N2OS/c1-13-8-16(9-14(2)20(13)26-19(28)11-21(3,4)5)27-7-6-17-15(12-27)10-18(29-17)22(23,24)25/h8-10H,6-7,11-12H2,1-5H3,(H,26,28)
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Nanjing University of Technology

Curated by ChEMBL


Assay Description
Channel opening activity at KCNQ2 (unknown origin) expressed in CHO cells after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 3004-3008 (2018)


Article DOI: 10.1016/j.bmcl.2018.05.019
BindingDB Entry DOI: 10.7270/Q2H997WB
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50272438
PNG
(CHEMBL4128096)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCC(=O)CC1
Show InChI InChI=1S/C19H28N2O2/c1-13-10-15(21-8-6-16(22)7-9-21)11-14(2)18(13)20-17(23)12-19(3,4)5/h10-11H,6-9,12H2,1-5H3,(H,20,23)
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Article
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n/an/an/an/a 130n/an/an/an/a



Nanjing University of Technology

Curated by ChEMBL


Assay Description
Activation of KCNQ2 (unknown origin) expressed in CHO cells at 10 uM after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 1731-1735 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.040
BindingDB Entry DOI: 10.7270/Q25X2CFM
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50463339
PNG
(CHEMBL4250839)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCCCc2cc(Cl)ccc12
Show InChI InChI=1S/C24H31ClN2O/c1-16-12-20(13-17(2)23(16)26-22(28)15-24(3,4)5)27-11-7-6-8-18-14-19(25)9-10-21(18)27/h9-10,12-14H,6-8,11,15H2,1-5H3,(H,26,28)
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n/an/an/an/a 140n/an/an/an/a



Nanjing University of Technology

Curated by ChEMBL


Assay Description
Channel opening activity at KCNQ2 (unknown origin) expressed in CHO cells after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 3004-3008 (2018)


Article DOI: 10.1016/j.bmcl.2018.05.019
BindingDB Entry DOI: 10.7270/Q2H997WB
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM557804
PNG
(US11365181, Compound 03027)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCCc2cscc2C1
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n/an/an/an/a 147n/an/an/an/a


TBA

Assay Description
Cell preparation: CHO-KCNQ2 cells were cultured in a 175 cm2 culture flask, and when the cells was grown to a density of 60-80%, the culture medium w...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2BC42RQ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50143558
PNG
(CHEMBL41355 | EZOGABINE | N-(2-amino-4-(4-fluorobe...)
Show SMILES CCOC(=O)Nc1ccc(NCc2ccc(F)cc2)cc1N
Show InChI InChI=1S/C16H18FN3O2/c1-2-22-16(21)20-15-8-7-13(9-14(15)18)19-10-11-3-5-12(17)6-4-11/h3-9,19H,2,10,18H2,1H3,(H,20,21)
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n/an/an/an/a<150n/an/an/an/a



NeuroSearch A/S

Curated by ChEMBL


Assay Description
Activity at Kv 7.2 channel expressed in cloned CHO cells by [86Rb] efflux assay


J Med Chem 50: 2576-82 (2007)


Article DOI: 10.1021/jm060989l
BindingDB Entry DOI: 10.7270/Q2PR7ZRH
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Potassium voltage-gated channel subfamily KQT member 4


(Homo sapiens (Human))
BDBM50465777
PNG
(CHEMBL4288707)
Show SMILES C[C@H](NC(=O)c1cc(F)c(F)cc1Oc1ccccc1)c1cccc(c1)S(C)(=O)=O |r|
Show InChI InChI=1S/C22H19F2NO4S/c1-14(15-7-6-10-17(11-15)30(2,27)28)25-22(26)18-12-19(23)20(24)13-21(18)29-16-8-4-3-5-9-16/h3-14H,1-2H3,(H,25,26)/t14-/m0/s1
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n/an/an/an/a 160n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Activation of human Kv7.4 by patch clamp method


Bioorg Med Chem Lett 28: 3793-3797 (2018)


Article DOI: 10.1016/j.bmcl.2018.09.036
BindingDB Entry DOI: 10.7270/Q28W3H0D
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50395486
PNG
(CHEMBL2163660)
Show SMILES Clc1cccc(CC(=O)Nc2ccccc2N2CCCC2)c1
Show InChI InChI=1S/C18H19ClN2O/c19-15-7-5-6-14(12-15)13-18(22)20-16-8-1-2-9-17(16)21-10-3-4-11-21/h1-2,5-9,12H,3-4,10-11,13H2,(H,20,22)
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Agonist activity at KCNQ2 expressed in CHO cells incubated for 3 mins by automated patch clamp assay


J Med Chem 55: 6975-9 (2012)


Article DOI: 10.1021/jm300700v
BindingDB Entry DOI: 10.7270/Q2KD2017
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50272437
PNG
(CHEMBL4125892)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCC(CC1)c1cccc(F)c1
Show InChI InChI=1S/C25H33FN2O/c1-17-13-22(14-18(2)24(17)27-23(29)16-25(3,4)5)28-11-9-19(10-12-28)20-7-6-8-21(26)15-20/h6-8,13-15,19H,9-12,16H2,1-5H3,(H,27,29)
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Nanjing University of Technology

Curated by ChEMBL


Assay Description
Activation of KCNQ2 (unknown origin) expressed in CHO cells at 10 uM after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 1731-1735 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.040
BindingDB Entry DOI: 10.7270/Q25X2CFM
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50463344
PNG
(CHEMBL4246564)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCCCc2cc(F)ccc12
Show InChI InChI=1S/C24H31FN2O/c1-16-12-20(13-17(2)23(16)26-22(28)15-24(3,4)5)27-11-7-6-8-18-14-19(25)9-10-21(18)27/h9-10,12-14H,6-8,11,15H2,1-5H3,(H,26,28)
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Nanjing University of Technology

Curated by ChEMBL


Assay Description
Channel opening activity at KCNQ2 (unknown origin) expressed in CHO cells after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 3004-3008 (2018)


Article DOI: 10.1016/j.bmcl.2018.05.019
BindingDB Entry DOI: 10.7270/Q2H997WB
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM557811
PNG
(US11365181, Compound 03049)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCCCc2sc(Cl)cc12
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TBA

Assay Description
Cell preparation: CHO-KCNQ2 cells were cultured in a 175 cm2 culture flask, and when the cells was grown to a density of 60-80%, the culture medium w...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2BC42RQ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1


(Homo sapiens (Human))
BDBM50390916
PNG
(CHEMBL2070953)
Show SMILES COc1ccc(cc1)-c1csc(NC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(C)cc2)n1 |r|
Show InChI InChI=1S/C23H25N3O4S2/c1-16-6-12-19(13-7-16)32(28,29)26-14-4-3-5-21(26)22(27)25-23-24-20(15-31-23)17-8-10-18(30-2)11-9-17/h6-13,15,21H,3-5,14H2,1-2H3,(H,24,25,27)/t21-/m1/s1
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n/an/an/an/a 260n/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Activation of Kv7.1 channel expressed in CHO cells assessed as depolarization-induced thallium influx after 3 mins by patch clamp assay


Bioorg Med Chem Lett 22: 5936-41 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.060
BindingDB Entry DOI: 10.7270/Q25T3MKN
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM557805
PNG
(US11365181, Compound 03028)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCCc2sccc2C1
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n/an/an/an/a 272n/an/an/an/a


TBA

Assay Description
Cell preparation: CHO-KCNQ2 cells were cultured in a 175 cm2 culture flask, and when the cells was grown to a density of 60-80%, the culture medium w...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2BC42RQ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50463348
PNG
(CHEMBL4246239)
Show SMILES Cc1cc(cc(C)c1NC(=O)CC(C)(C)C)N1CCc2sc(cc2C1)C#N
Show InChI InChI=1S/C22H27N3OS/c1-14-8-17(9-15(2)21(14)24-20(26)11-22(3,4)5)25-7-6-19-16(13-25)10-18(12-23)27-19/h8-10H,6-7,11,13H2,1-5H3,(H,24,26)
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Nanjing University of Technology

Curated by ChEMBL


Assay Description
Channel opening activity at KCNQ2 (unknown origin) expressed in CHO cells after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 3004-3008 (2018)


Article DOI: 10.1016/j.bmcl.2018.05.019
BindingDB Entry DOI: 10.7270/Q2H997WB
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50463338
PNG
(CHEMBL4244768)
Show SMILES Cc1csc2CCN(Cc12)c1cc(C)c(NC(=O)CC(C)(C)C)c(C)c1
Show InChI InChI=1S/C22H30N2OS/c1-14-9-17(24-8-7-19-18(12-24)16(3)13-26-19)10-15(2)21(14)23-20(25)11-22(4,5)6/h9-10,13H,7-8,11-12H2,1-6H3,(H,23,25)
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Nanjing University of Technology

Curated by ChEMBL


Assay Description
Channel opening activity at KCNQ2 (unknown origin) expressed in CHO cells after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 3004-3008 (2018)


Article DOI: 10.1016/j.bmcl.2018.05.019
BindingDB Entry DOI: 10.7270/Q2H997WB
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 4


(Homo sapiens (Human))
BDBM50592355
PNG
(CHEMBL5200636)
Show SMILES Nc1c(F)c(NCc2ncc(cc2F)C(F)(F)F)c(F)c(F)c1NC(=O)OC1CC1
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n/an/an/an/a 320n/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128841
BindingDB Entry DOI: 10.7270/Q2571H05
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50272436
PNG
(CHEMBL4126113)
Show SMILES Cc1cc(CN2CCCc3ccccc23)cc(C)c1NC(=O)CC(C)(C)C
Show InChI InChI=1S/C24H32N2O/c1-17-13-19(14-18(2)23(17)25-22(27)15-24(3,4)5)16-26-12-8-10-20-9-6-7-11-21(20)26/h6-7,9,11,13-14H,8,10,12,15-16H2,1-5H3,(H,25,27)
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n/an/an/an/a 330n/an/an/an/a



Nanjing University of Technology

Curated by ChEMBL


Assay Description
Activation of KCNQ2 (unknown origin) expressed in CHO cells at 10 uM after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 1731-1735 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.040
BindingDB Entry DOI: 10.7270/Q25X2CFM
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 5


(Homo sapiens (Human))
BDBM50526876
PNG
(CHEMBL4457044)
Show SMILES CC(C)(C)CC(=O)Nc1ccc2n(Cc3ccc(cc3)C(F)(F)F)ccc2c1
Show InChI InChI=1S/C22H23F3N2O/c1-21(2,3)13-20(28)26-18-8-9-19-16(12-18)10-11-27(19)14-15-4-6-17(7-5-15)22(23,24)25/h4-12H,13-14H2,1-3H3,(H,26,28)
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University Federico II of Naples

Curated by ChEMBL


Assay Description
Activation of human Kv7.5 expressed in CHO cells assessed as increase in channel current amplitude by whole cell patch clamp electrophysiology assay


J Med Chem 63: 163-185 (2020)


Article DOI: 10.1021/acs.jmedchem.9b00796
BindingDB Entry DOI: 10.7270/Q2KW5KG2
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50143558
PNG
(CHEMBL41355 | EZOGABINE | N-(2-amino-4-(4-fluorobe...)
Show SMILES CCOC(=O)Nc1ccc(NCc2ccc(F)cc2)cc1N
Show InChI InChI=1S/C16H18FN3O2/c1-2-22-16(21)20-15-8-7-13(9-14(15)18)19-10-11-3-5-12(17)6-4-11/h3-9,19H,2,10,18H2,1H3,(H,20,21)
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n/an/an/an/a 350n/an/an/an/a



Nanjing University of Technology

Curated by ChEMBL


Assay Description
Channel opening activity at KCNQ2 (unknown origin) expressed in CHO cells after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 3004-3008 (2018)


Article DOI: 10.1016/j.bmcl.2018.05.019
BindingDB Entry DOI: 10.7270/Q2H997WB
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50143558
PNG
(CHEMBL41355 | EZOGABINE | N-(2-amino-4-(4-fluorobe...)
Show SMILES CCOC(=O)Nc1ccc(NCc2ccc(F)cc2)cc1N
Show InChI InChI=1S/C16H18FN3O2/c1-2-22-16(21)20-15-8-7-13(9-14(15)18)19-10-11-3-5-12(17)6-4-11/h3-9,19H,2,10,18H2,1H3,(H,20,21)
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n/an/an/an/a 350n/an/an/an/a



Nanjing University of Technology

Curated by ChEMBL


Assay Description
Activation of KCNQ2 (unknown origin) expressed in CHO cells at 10 uM after 10 mins by atomic absorption spectrophotometry-based Rb+ flow assay


Bioorg Med Chem Lett 28: 1731-1735 (2018)


Article DOI: 10.1016/j.bmcl.2018.04.040
BindingDB Entry DOI: 10.7270/Q25X2CFM
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50395488
PNG
(CHEMBL1572950)
Show SMILES FC(F)(F)c1cccc(CC(=O)Nc2ccccc2N2CCCC2)c1
Show InChI InChI=1S/C19H19F3N2O/c20-19(21,22)15-7-5-6-14(12-15)13-18(25)23-16-8-1-2-9-17(16)24-10-3-4-11-24/h1-2,5-9,12H,3-4,10-11,13H2,(H,23,25)
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Agonist activity at KCNQ2 expressed in CHO cells incubated for 3 mins by automated patch clamp assay


J Med Chem 55: 6975-9 (2012)


Article DOI: 10.1021/jm300700v
BindingDB Entry DOI: 10.7270/Q2KD2017
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM557808
PNG
(US11365181, Compound 03039)
Show SMILES Cc1cc2N(CCCCc2s1)c1cc(C)c(NC(=O)CC(C)(C)C)c(C)c1
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n/an/an/an/a 409n/an/an/an/a


TBA

Assay Description
Cell preparation: CHO-KCNQ2 cells were cultured in a 175 cm2 culture flask, and when the cells was grown to a density of 60-80%, the culture medium w...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2BC42RQ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1


(Homo sapiens (Human))
BDBM50390878
PNG
(CHEMBL2070970)
Show SMILES COc1ccc(cc1)-c1csc(NC(=O)[C@H]2CCCCN2S(=O)(=O)c2ccc(Cl)cc2)n1 |r|
Show InChI InChI=1S/C22H22ClN3O4S2/c1-30-17-9-5-15(6-10-17)19-14-31-22(24-19)25-21(27)20-4-2-3-13-26(20)32(28,29)18-11-7-16(23)8-12-18/h5-12,14,20H,2-4,13H2,1H3,(H,24,25,27)/t20-/m1/s1
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Activation of Kv7.1 channel expressed in CHO cells assessed as depolarization-induced thallium influx after 3 mins by patch clamp assay


Bioorg Med Chem Lett 22: 5936-41 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.060
BindingDB Entry DOI: 10.7270/Q25T3MKN
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50395493
PNG
(CHEMBL2164065)
Show SMILES Fc1cccc(CC(=O)Nc2ccccc2N2CCCC2)c1
Show InChI InChI=1S/C18H19FN2O/c19-15-7-5-6-14(12-15)13-18(22)20-16-8-1-2-9-17(16)21-10-3-4-11-21/h1-2,5-9,12H,3-4,10-11,13H2,(H,20,22)
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Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Agonist activity at KCNQ2 expressed in CHO cells incubated for 3 mins by automated patch clamp assay


J Med Chem 55: 6975-9 (2012)


Article DOI: 10.1021/jm300700v
BindingDB Entry DOI: 10.7270/Q2KD2017
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 5


(Homo sapiens (Human))
BDBM50592360
PNG
(CHEMBL4549229)
Show SMILES CCOC(=O)Nc1ccc(NCc2ccc(nc2)C(F)(F)F)c(F)c1N
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TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128841
BindingDB Entry DOI: 10.7270/Q2571H05
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1


(Homo sapiens (Human))
BDBM50390895
PNG
(CHEMBL2070988)
Show SMILES COc1ccc(cc1)-c1csc(NC(=O)C2CSCCN2S(=O)(=O)c2ccc(C)cc2)n1
Show InChI InChI=1S/C22H23N3O4S3/c1-15-3-9-18(10-4-15)32(27,28)25-11-12-30-14-20(25)21(26)24-22-23-19(13-31-22)16-5-7-17(29-2)8-6-16/h3-10,13,20H,11-12,14H2,1-2H3,(H,23,24,26)
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PubMed
n/an/an/an/a 600n/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Activation of Kv7.1 channel expressed in CHO cells assessed as depolarization-induced thallium influx after 3 mins by patch clamp assay


Bioorg Med Chem Lett 22: 5936-41 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.060
BindingDB Entry DOI: 10.7270/Q25T3MKN
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 4


(Homo sapiens (Human))
BDBM50121051
PNG
(CHEMBL3621437)
Show SMILES COC1CCN(CC1)c1nc(OC)c(NC(=O)CC(C)(C)C)c(OC)n1
Show InChI InChI=1S/C18H30N4O4/c1-18(2,3)11-13(23)19-14-15(25-5)20-17(21-16(14)26-6)22-9-7-12(24-4)8-10-22/h12H,7-11H2,1-6H3,(H,19,23)
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n/an/an/an/a 625n/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Activation of human Kv7.4 expressed in CHOK1 cells


Bioorg Med Chem Lett 25: 4941-4 (2015)


Article DOI: 10.1016/j.bmcl.2015.04.074
BindingDB Entry DOI: 10.7270/Q28054FG
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50526876
PNG
(CHEMBL4457044)
Show SMILES CC(C)(C)CC(=O)Nc1ccc2n(Cc3ccc(cc3)C(F)(F)F)ccc2c1
Show InChI InChI=1S/C22H23F3N2O/c1-21(2,3)13-20(28)26-18-8-9-19-16(12-18)10-11-27(19)14-15-4-6-17(7-5-15)22(23,24)25/h4-12H,13-14H2,1-3H3,(H,26,28)
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n/an/an/an/a 630n/an/an/an/a



University Federico II of Naples

Curated by ChEMBL


Assay Description
Activation of human Kv7.2 expressed in CHO cells assessed as increase in channel current amplitude by whole cell patch clamp electrophysiology assay


J Med Chem 63: 163-185 (2020)


Article DOI: 10.1021/acs.jmedchem.9b00796
BindingDB Entry DOI: 10.7270/Q2KW5KG2
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 4


(Homo sapiens (Human))
BDBM50592360
PNG
(CHEMBL4549229)
Show SMILES CCOC(=O)Nc1ccc(NCc2ccc(nc2)C(F)(F)F)c(F)c1N
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n/an/an/an/a 660n/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1016/j.bmcl.2022.128841
BindingDB Entry DOI: 10.7270/Q2571H05
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 2


(Homo sapiens (Human))
BDBM50130610
PNG
((E)-N-[(S)-1-(3-Morpholin-4-yl-phenyl)-ethyl]-3-ph...)
Show SMILES C[C@H](NC(=O)\C=C\c1ccccc1)c1cccc(c1)N1CCOCC1
Show InChI InChI=1S/C21H24N2O2/c1-17(22-21(24)11-10-18-6-3-2-4-7-18)19-8-5-9-20(16-19)23-12-14-25-15-13-23/h2-11,16-17H,12-15H2,1H3,(H,22,24)/b11-10+/t17-/m0/s1
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n/an/an/an/a 690n/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Effective concentration against Potassium voltage gated channel, KQT-like subfamily, member 2 expressed in SH-SY5Y human neuroblastoma cells


J Med Chem 46: 3778-81 (2003)


Article DOI: 10.1021/jm034111v
BindingDB Entry DOI: 10.7270/Q2RJ4K66
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 1


(Homo sapiens (Human))
BDBM50390922
PNG
(CHEMBL2070954)
Show SMILES CCCc1ccc(cc1)S(=O)(=O)N1CCCC[C@@H]1C(=O)Nc1nc(cs1)-c1ccc(OC)cc1 |r|
Show InChI InChI=1S/C25H29N3O4S2/c1-3-6-18-8-14-21(15-9-18)34(30,31)28-16-5-4-7-23(28)24(29)27-25-26-22(17-33-25)19-10-12-20(32-2)13-11-19/h8-15,17,23H,3-7,16H2,1-2H3,(H,26,27,29)/t23-/m1/s1
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n/an/an/an/a 700n/an/an/an/a



Vanderbilt University Medical Center

Curated by ChEMBL


Assay Description
Activation of Kv7.1 channel expressed in CHO cells assessed as depolarization-induced thallium influx after 3 mins by patch clamp assay


Bioorg Med Chem Lett 22: 5936-41 (2012)


Article DOI: 10.1016/j.bmcl.2012.07.060
BindingDB Entry DOI: 10.7270/Q25T3MKN
More data for this
Ligand-Target Pair
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