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PubChem AID 2603

Compile data set for download or QSAR
Found 36 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
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65876
PNG
(4-(3-hydroxyphenyl)-2-keto-6-methyl-3,4-dihydro-1H...)
Show SMILES CC1=NC(=O)NC(C1C(=O)OC1CCCCCCC1)c1cccc(O)c1
Show InChI InChI=1S/C20H26N2O4/c1-13-17(19(24)26-16-10-5-3-2-4-6-11-16)18(22-20(25)21-13)14-8-7-9-15(23)12-14/h7-9,12,16-18,23H,2-6,10-11H2,1H3,(H,22,25)
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n/an/an/an/a 5.37E+5n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65902
PNG
(5-chloranyl-2-[(3-methylphenyl)methylsulfonyl]-N-(...)
Show SMILES CSc1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2cccc(C)c2)s1
Show InChI InChI=1S/C16H14ClN5O3S3/c1-9-4-3-5-10(6-9)8-28(24,25)15-18-7-11(17)12(19-15)13(23)20-14-21-22-16(26-2)27-14/h3-7H,8H2,1-2H3,(H,20,21,23)
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n/an/an/an/a 1.83E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65889
PNG
(1-[(2,2-dichlorocyclopropyl)methyl]-3-(4-methylphe...)
Show SMILES Cc1ccc(NC(=O)NCC2CC2(Cl)Cl)cc1
Show InChI InChI=1S/C12H14Cl2N2O/c1-8-2-4-10(5-3-8)16-11(17)15-7-9-6-12(9,13)14/h2-5,9H,6-7H2,1H3,(H2,15,16,17)
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n/an/an/an/a 2.17E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM48038
PNG
(4-[(E)-[3-(2-methylanilino)-4-oxo-1-naphthalenylid...)
Show SMILES Cc1ccccc1NC1=CC(=NS(=O)(=O)c2ccc(cc2)C(O)=O)c2ccccc2C1=O
Show InChI InChI=1S/C24H18N2O5S/c1-15-6-2-5-9-20(15)25-22-14-21(18-7-3-4-8-19(18)23(22)27)26-32(30,31)17-12-10-16(11-13-17)24(28)29/h2-14,25H,1H3,(H,28,29)
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n/an/an/an/a 9.51E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65880
PNG
(MLS000529853 | S-[2-[(6-fluoranyl-3-prop-2-ynyl-1,...)
Show SMILES CC(=O)SCC(=O)N=c1sc2cc(F)ccc2n1CC#C
Show InChI InChI=1S/C14H11FN2O2S2/c1-3-6-17-11-5-4-10(15)7-12(11)21-14(17)16-13(19)8-20-9(2)18/h1,4-5,7H,6,8H2,2H3
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n/an/an/an/a 2.97E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65883
PNG
(2-chloranyl-5-[(2Z)-2-(2-oxidanylidene-1-propan-2-...)
Show SMILES CC(C)N1C(=O)C(=NNc2ccc(Cl)c(c2)C(O)=O)c2ccccc12
Show InChI InChI=1S/C18H16ClN3O3/c1-10(2)22-15-6-4-3-5-12(15)16(17(22)23)21-20-11-7-8-14(19)13(9-11)18(24)25/h3-10,20H,1-2H3,(H,24,25)
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n/an/an/an/a 3.70E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65886
PNG
(1-(4-phenoxyphenyl)-3-(3-pyridinyl)thiourea | 1-(4...)
Show SMILES S=C(Nc1ccc(Oc2ccccc2)cc1)Nc1cccnc1
Show InChI InChI=1S/C18H15N3OS/c23-18(21-15-5-4-12-19-13-15)20-14-8-10-17(11-9-14)22-16-6-2-1-3-7-16/h1-13H,(H2,20,21,23)
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n/an/an/an/a 7.25E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65901
PNG
(5-chloranyl-2-[(2-fluorophenyl)methylsulfonyl]-N-(...)
Show SMILES CSc1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccccc2F)s1
Show InChI InChI=1S/C15H11ClFN5O3S3/c1-26-15-22-21-13(27-15)20-12(23)11-9(16)6-18-14(19-11)28(24,25)7-8-4-2-3-5-10(8)17/h2-6H,7H2,1H3,(H,20,21,23)
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n/an/an/an/a 4.19E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65877
PNG
((6E)-2,4-bis(chloranyl)-6-[(1,3-thiazol-2-ylamino)...)
Show SMILES Oc1c(Cl)cc(Cl)cc1C=Nc1nccs1
Show InChI InChI=1S/C10H6Cl2N2OS/c11-7-3-6(9(15)8(12)4-7)5-14-10-13-1-2-16-10/h1-5,15H
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n/an/an/an/a 1.16E+4n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65270
PNG
(MLS000705220 | N'-(5-bromo-3-chloro-2-hydroxyb...)
Show SMILES Oc1c(Cl)cc(Br)cc1C=NNC(=O)Cc1ccccc1
Show InChI InChI=1S/C15H12BrClN2O2/c16-12-7-11(15(21)13(17)8-12)9-18-19-14(20)6-10-4-2-1-3-5-10/h1-5,7-9,21H,6H2,(H,19,20)
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n/an/an/an/a 7.13E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65879
PNG
(2-(dimethylcarbamoylthiocarbamoylamino)-4-(5-methy...)
Show SMILES CCOC(=O)c1c(NC(=S)NC(=O)N(C)C)scc1-c1ccc(C)o1
Show InChI InChI=1S/C16H19N3O4S2/c1-5-22-14(20)12-10(11-7-6-9(2)23-11)8-25-13(12)17-15(24)18-16(21)19(3)4/h6-8H,5H2,1-4H3,(H2,17,18,21,24)
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n/an/an/an/a 3.01E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM63846
PNG
((4-Chloro-phenyl)-(6-chloro-pyridazin-3-yl)-amine ...)
Show SMILES Clc1ccc(Nc2ccc(Cl)nn2)cc1
Show InChI InChI=1S/C10H7Cl2N3/c11-7-1-3-8(4-2-7)13-10-6-5-9(12)14-15-10/h1-6H,(H,13,15)
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n/an/an/an/a 7.86E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65891
PNG
(5-chloranyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(...)
Show SMILES CCc1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2cccc(C)c2)s1
Show InChI InChI=1S/C17H16ClN5O3S2/c1-3-13-22-23-16(27-13)21-15(24)14-12(18)8-19-17(20-14)28(25,26)9-11-6-4-5-10(2)7-11/h4-8H,3,9H2,1-2H3,(H,21,23,24)
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n/an/an/an/a 1.68E+4n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65894
PNG
(5-chloranyl-2-[(3-methylphenyl)methylsulfonyl]-N-(...)
Show SMILES CCCc1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2cccc(C)c2)s1
Show InChI InChI=1S/C18H18ClN5O3S2/c1-3-5-14-23-24-17(28-14)22-16(25)15-13(19)9-20-18(21-15)29(26,27)10-12-7-4-6-11(2)8-12/h4,6-9H,3,5,10H2,1-2H3,(H,22,24,25)
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n/an/an/an/a 2.89E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65900
PNG
(5-chloranyl-2-[(2-fluorophenyl)methylsulfonyl]-N-(...)
Show SMILES CC(C)c1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccccc2F)s1
Show InChI InChI=1S/C17H15ClFN5O3S2/c1-9(2)15-23-24-16(28-15)22-14(25)13-11(18)7-20-17(21-13)29(26,27)8-10-5-3-4-6-12(10)19/h3-7,9H,8H2,1-2H3,(H,22,24,25)
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n/an/an/an/a 8.40E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65903
PNG
(4-butyl-N-[2-(2-furanyl)-2-(4-morpholinyl)ethyl]-1...)
Show SMILES CCCCC1CCC(CC1)C(=O)NCC(N1CCOCC1)c1ccco1
Show InChI InChI=1S/C21H34N2O3/c1-2-3-5-17-7-9-18(10-8-17)21(24)22-16-19(20-6-4-13-26-20)23-11-14-25-15-12-23/h4,6,13,17-19H,2-3,5,7-12,14-16H2,1H3,(H,22,24)
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n/an/an/an/a 920n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65904
PNG
(1-[1-(1,3-benzodioxol-5-yl)ethyl]-3-(2-ethoxypheny...)
Show SMILES CCOc1ccccc1NC(=O)NC(C)c1ccc2OCOc2c1
Show InChI InChI=1S/C18H20N2O4/c1-3-22-15-7-5-4-6-14(15)20-18(21)19-12(2)13-8-9-16-17(10-13)24-11-23-16/h4-10,12H,3,11H2,1-2H3,(H2,19,20,21)
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n/an/an/an/a 1.51E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65882
PNG
(2-[(5-fluoro-3-nitro-1H-indol-2-yl)thio]acetic aci...)
Show SMILES COC(=O)CSc1[nH]c2ccc(F)cc2c1[N+]([O-])=O
Show InChI InChI=1S/C11H9FN2O4S/c1-18-9(15)5-19-11-10(14(16)17)7-4-6(12)2-3-8(7)13-11/h2-4,13H,5H2,1H3
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n/an/an/an/a 170n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65896
PNG
(2-benzylsulfonyl-5-chloro-N-(5-ethyl-1,3,4-thiadia...)
Show SMILES CCc1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccccc2)s1
Show InChI InChI=1S/C16H14ClN5O3S2/c1-2-12-21-22-15(26-12)20-14(23)13-11(17)8-18-16(19-13)27(24,25)9-10-6-4-3-5-7-10/h3-8H,2,9H2,1H3,(H,20,22,23)
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n/an/an/an/a 1.73E+4n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65899
PNG
(5-chloranyl-N-(5-ethyl-1,3,4-thiadiazol-2-yl)-2-[(...)
Show SMILES CCc1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccc(C)cc2)s1
Show InChI InChI=1S/C17H16ClN5O3S2/c1-3-13-22-23-16(27-13)21-15(24)14-12(18)8-19-17(20-14)28(25,26)9-11-6-4-10(2)5-7-11/h4-8H,3,9H2,1-2H3,(H,21,23,24)
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n/an/an/an/a 4.80E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65884
PNG
((4-Chloro-phenyl)-(5-hydroxy-2-methyl-4,6-dinitro-...)
Show SMILES Cc1oc2cc(c(O)c([N+]([O-])=O)c2c1C(=O)c1ccc(Cl)cc1)[N+]([O-])=O
Show InChI InChI=1S/C16H9ClN2O7/c1-7-12(15(20)8-2-4-9(17)5-3-8)13-11(26-7)6-10(18(22)23)16(21)14(13)19(24)25/h2-6,21H,1H3
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n/an/an/an/a 5.55E+5n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65885
PNG
(MLS001000844 | N-(4-methyl-2-nitro-phenyl)-2-pheny...)
Show SMILES Cc1ccc(NC(=O)C2CC2c2ccccc2)c(c1)[N+]([O-])=O
Show InChI InChI=1S/C17H16N2O3/c1-11-7-8-15(16(9-11)19(21)22)18-17(20)14-10-13(14)12-5-3-2-4-6-12/h2-9,13-14H,10H2,1H3,(H,18,20)
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n/an/an/an/a 1.14E+4n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65890
PNG
(5-chloranyl-2-[(4-methylphenyl)methylsulfonyl]-N-(...)
Show SMILES CCCc1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccc(C)cc2)s1
Show InChI InChI=1S/C18H18ClN5O3S2/c1-3-4-14-23-24-17(28-14)22-16(25)15-13(19)9-20-18(21-15)29(26,27)10-12-7-5-11(2)6-8-12/h5-9H,3-4,10H2,1-2H3,(H,22,24,25)
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n/an/an/an/a 3.02E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65895
PNG
(5-chloranyl-N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-...)
Show SMILES CCSc1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccc(F)cc2)s1
Show InChI InChI=1S/C16H13ClFN5O3S3/c1-2-27-16-23-22-14(28-16)21-13(24)12-11(17)7-19-15(20-12)29(25,26)8-9-3-5-10(18)6-4-9/h3-7H,2,8H2,1H3,(H,21,22,24)
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n/an/an/an/a 3.89E+4n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65875
PNG
(5-bromanyl-N-[3-(trifluoromethyloxy)phenyl]furan-2...)
Show SMILES FC(F)(F)Oc1cccc(NC(=O)c2ccc(Br)o2)c1
Show InChI InChI=1S/C12H7BrF3NO3/c13-10-5-4-9(19-10)11(18)17-7-2-1-3-8(6-7)20-12(14,15)16/h1-6H,(H,17,18)
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n/an/an/an/a 1.38E+4n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65892
PNG
(5-chloranyl-2-[(4-methylphenyl)methylsulfonyl]-N-(...)
Show SMILES CSc1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccc(C)cc2)s1
Show InChI InChI=1S/C16H14ClN5O3S3/c1-9-3-5-10(6-4-9)8-28(24,25)15-18-7-11(17)12(19-15)13(23)20-14-21-22-16(26-2)27-14/h3-7H,8H2,1-2H3,(H,20,21,23)
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n/an/an/an/a 3.49E+4n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65893
PNG
(5-chloranyl-2-[(2-methylphenyl)methylsulfonyl]-N-(...)
Show SMILES Cc1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccccc2C)s1
Show InChI InChI=1S/C16H14ClN5O3S2/c1-9-5-3-4-6-11(9)8-27(24,25)16-18-7-12(17)13(19-16)14(23)20-15-22-21-10(2)26-15/h3-7H,8H2,1-2H3,(H,20,22,23)
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n/an/an/an/a 6.92E+5n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65897
PNG
(5-chloranyl-2-[(4-methylphenyl)methylsulfonyl]-N-(...)
Show SMILES Cc1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccc(C)cc2)s1
Show InChI InChI=1S/C16H14ClN5O3S2/c1-9-3-5-11(6-4-9)8-27(24,25)16-18-7-12(17)13(19-16)14(23)20-15-22-21-10(2)26-15/h3-7H,8H2,1-2H3,(H,20,22,23)
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n/an/an/an/a 5.40E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65898
PNG
(2-benzylsulfonyl-5-chloro-N-(5-isopropyl-1,3,4-thi...)
Show SMILES CC(C)c1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccccc2)s1
Show InChI InChI=1S/C17H16ClN5O3S2/c1-10(2)15-22-23-16(27-15)21-14(24)13-12(18)8-19-17(20-13)28(25,26)9-11-6-4-3-5-7-11/h3-8,10H,9H2,1-2H3,(H,21,23,24)
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n/an/an/an/a 6.20E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65905
PNG
(3-(4-tert-butylphenoxy)-N-(2-morpholin-4-yl-2-thio...)
Show SMILES CC(C)(C)c1ccc(OCCC(=O)NCC(N2CCOCC2)c2cccs2)cc1
Show InChI InChI=1S/C23H32N2O3S/c1-23(2,3)18-6-8-19(9-7-18)28-13-10-22(26)24-17-20(21-5-4-16-29-21)25-11-14-27-15-12-25/h4-9,16,20H,10-15,17H2,1-3H3,(H,24,26)
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n/an/an/an/a 1.97E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65878
PNG
(MLS000547588 | N-(4-naphthalen-2-yloxyphenyl)furan...)
Show SMILES O=C(Nc1ccc(Oc2ccc3ccccc3c2)cc1)c1ccco1
Show InChI InChI=1S/C21H15NO3/c23-21(20-6-3-13-24-20)22-17-8-11-18(12-9-17)25-19-10-7-15-4-1-2-5-16(15)14-19/h1-14H,(H,22,23)
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n/an/an/an/a 1.20E+4n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM47762
PNG
(4-butyl-3-(5-isopropyl-3-thienyl)-1H-1,2,4-triazol...)
Show SMILES CCCCn1c(n[nH]c1=S)-c1csc(c1)C(C)C
Show InChI InChI=1S/C13H19N3S2/c1-4-5-6-16-12(14-15-13(16)17)10-7-11(9(2)3)18-8-10/h7-9H,4-6H2,1-3H3,(H,15,17)
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n/an/an/an/a 3.08E+5n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65881
PNG
(2-(4-chloro-2-methyl-5-{[4-(2-pyridinyl)-1-piperaz...)
Show SMILES Cc1cc(Cl)c(cc1OCC(=O)NC1CCCCC1)S(=O)(=O)N1CCN(CC1)c1ccccn1
Show InChI InChI=1S/C24H31ClN4O4S/c1-18-15-20(25)22(16-21(18)33-17-24(30)27-19-7-3-2-4-8-19)34(31,32)29-13-11-28(12-14-29)23-9-5-6-10-26-23/h5-6,9-10,15-16,19H,2-4,7-8,11-14,17H2,1H3,(H,27,30)
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n/an/an/an/a 5.34E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65888
PNG
((2',4'-Dimethyl-[4,5']bithiazolyl-2-yl...)
Show SMILES Cc1nc(C)c(s1)-c1csc(Nc2ccccn2)n1
Show InChI InChI=1S/C13H12N4S2/c1-8-12(19-9(2)15-8)10-7-18-13(16-10)17-11-5-3-4-6-14-11/h3-7H,1-2H3,(H,14,16,17)
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n/an/an/an/a 1.15E+5n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM64280
PNG
(5-chloranyl-2-[(4-fluorophenyl)methylsulfonyl]-N-(...)
Show SMILES CC(C)c1nnc(NC(=O)c2nc(ncc2Cl)S(=O)(=O)Cc2ccc(F)cc2)s1
Show InChI InChI=1S/C17H15ClFN5O3S2/c1-9(2)15-23-24-16(28-15)22-14(25)13-12(18)7-20-17(21-13)29(26,27)8-10-3-5-11(19)6-4-10/h3-7,9H,8H2,1-2H3,(H,22,24,25)
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n/an/an/an/a 4.47E+3n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv7.2


(Rattus norvegicus)
BDBM65887
PNG
(3,4-Dichloro-N-pyridin-3-yl-benzamide | 3,4-bis(ch...)
Show SMILES Clc1ccc(cc1Cl)C(=O)Nc1cccnc1
Show InChI InChI=1S/C12H8Cl2N2O/c13-10-4-3-8(6-11(10)14)12(17)16-9-2-1-5-15-7-9/h1-7H,(H,16,17)
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n/an/an/an/a 2.62E+4n/an/an/an/a



Johns Hopkins Ion Channel Center

Curated by PubChem BioAssay


Assay Description
BioAssay Type: Confirmatory, Concentration-Response Relationship Observed Source (MLPCN Center Name): Johns Hopkins Ion Channel Center (JHICC) Center...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q20000JS
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%