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Compile Data Set for Download or QSAR

Found 12 hits Enz. Inhib. hit(s) with Target = 'Potassium voltage-gated channel subfamily KQT member 3' AND taxid = 9606   
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 3


(Homo sapiens (Human))
BDBM50212239
PNG
(5-(4-chlorophenyl)-N-(3,5-dimethoxyphenyl)furan-2-...)
Show SMILES COc1cc(NC(=O)c2ccc(o2)-c2ccc(Cl)cc2)cc(OC)c1
Show InChI InChI=1S/C19H16ClNO4/c1-23-15-9-14(10-16(11-15)24-2)21-19(22)18-8-7-17(25-18)12-3-5-13(20)6-4-12/h3-11H,1-2H3,(H,21,22)
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n/an/a>1.00E+4n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of KCNQ3 channel


Proc Natl Acad Sci USA 104: 8520-5 (2007)


Article DOI: 10.1073/pnas.0611364104
BindingDB Entry DOI: 10.7270/Q2J10411
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 3/5


(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 200n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Activation of human Kv7.3/7.5 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 3/5


(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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n/an/an/an/a 360n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Activation of human Kv7.3/7.5 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 3/5


(Homo sapiens (Human))
BDBM50465779
PNG
(CHEMBL4278049)
Show SMILES CS(=O)(=O)c1cccc(c1)[C@H](CO)NC(=O)c1cc(ccc1Oc1ccccc1)S(F)(F)(F)(F)F |r|
Show InChI InChI=1S/C22H20F5NO5S2/c1-34(31,32)17-9-5-6-15(12-17)20(14-29)28-22(30)19-13-18(35(23,24,25,26)27)10-11-21(19)33-16-7-3-2-4-8-16/h2-13,20,29H,14H2,1H3,(H,28,30)/t20-/m0/s1
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n/an/an/an/a 80n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Activation of human Kv7.3/7.5 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 3


(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 1.05E+4n/an/an/an/a



University Federico II of Naples

Curated by ChEMBL


Assay Description
Activation of human Kv7.3 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 3/5


(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 250n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Activation of human Kv7.3/7.5 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 3/5


(Homo sapiens (Human))
BDBM50420049
PNG
(CHEMBL402146)
Show SMILES Fc1ccc(cc1F)C(=O)Nc1ccc(Cl)nc1
Show InChI InChI=1S/C12H7ClF2N2O/c13-11-4-2-8(6-16-11)17-12(18)7-1-3-9(14)10(15)5-7/h1-6H,(H,17,18)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Activation of human Kv7.3/7.5 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 3/5


(Homo sapiens (Human))
BDBM50465775
PNG
(CHEMBL1703636)
Show SMILES Cc1cc(C)c(NC(=O)C2CC3CCC2C3)c(C)c1 |TLB:7:9:15:13.12|
Show InChI InChI=1S/C17H23NO/c1-10-6-11(2)16(12(3)7-10)18-17(19)15-9-13-4-5-14(15)8-13/h6-7,13-15H,4-5,8-9H2,1-3H3,(H,18,19)
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n/an/an/an/a 500n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Activation of human Kv7.3/7.5 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 3


(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 3.90E+3n/an/an/an/a



University Federico II of Naples

Curated by ChEMBL


Assay Description
Activation of human Kv7.3 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 3


(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 920n/an/an/an/a



University Federico II of Naples

Curated by ChEMBL


Assay Description
Activation of human Kv7.3 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 3


(Homo sapiens (Human))
BDBM50426567
PNG
(BMS-204352 | FLINDOKALNER | MaxiPost)
Show SMILES COc1ccc(Cl)cc1[C@]1(F)C(=O)Nc2cc(ccc12)C(F)(F)F
Show InChI InChI=1S/C16H10ClF4NO2/c1-24-13-5-3-9(17)7-11(13)15(18)10-4-2-8(16(19,20)21)6-12(10)22-14(15)23/h2-7H,1H3,(H,22,23)/t15-/m0/s1
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n/an/an/an/a 2.40E+3n/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Positive modulatory activity at voltage-gated K channel 7.3 (unknown origin)


J Med Chem 56: 593-624 (2013)


Article DOI: 10.1021/jm3011433
BindingDB Entry DOI: 10.7270/Q23B61GZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily KQT member 3/5


(Homo sapiens (Human))
BDBM50465778
PNG
(CHEMBL4287478)
Show SMILES C[C@H](NC(=O)[C@H]1CC(F)(F)CC[C@@H]1c1ccccc1)c1ccccc1 |r|
Show InChI InChI=1S/C21H23F2NO/c1-15(16-8-4-2-5-9-16)24-20(25)19-14-21(22,23)13-12-18(19)17-10-6-3-7-11-17/h2-11,15,18-19H,12-14H2,1H3,(H,24,25)/t15-,18+,19-/m0/s1
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n/an/an/an/a 400n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Activation of human Kv7.3/7.5 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