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There are 24 purchasable compounds for target: HPCN1

Compile data set for download or QSAR
Wt: 346.3
BDBM50000778
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Wt: 440.9
BDBM50001786
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Wt: 234.3
BDBM50017662
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Wt: 216.1
BDBM50067880
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Wt: 465.5
BDBM50123508
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Wt: 500.5
BDBM50123519
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Wt: 414.3
BDBM50131434
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Wt: 380.4
BDBM50146383
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Wt: 394.4
BDBM50146384
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Wt: 394.4
BDBM50146389
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Wt: 556.7
BDBM50151864
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Wt: 350.3
BDBM50279106
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Wt: 207.2
BDBM50315565
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Wt: 340.4
BDBM50315563
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Wt: 516.5
BDBM50349984
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Displayed 1 to 15 (of 24 total )  |  Next  |  Last  >>

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 16 hits for monomerid = 50000778,50001786,50017662,50067880,50123508,50123519,50131434,50146383,50146384,50146389,50151864,50279106,50315565,50315563,50349984   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50151864
PNG
(CHEMBL184412 | DRONEDARONE | N-(2-butyl-3-(4-(3-(d...)
Show SMILES CCCCN(CCCC)CCCOc1ccc(cc1)C(=O)c1c(CCCC)oc2ccc(NS(C)(=O)=O)cc12
Show InChI InChI=1S/C31H44N2O5S/c1-5-8-12-29-30(27-23-25(32-39(4,35)36)15-18-28(27)38-29)31(34)24-13-16-26(17-14-24)37-22-11-21-33(19-9-6-2)20-10-7-3/h13-18,23,32H,5-12,19-22H2,1-4H3
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n/an/a 2.37E+3n/an/an/an/an/an/a



China Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in HEK293 cells by whole cell patch clamp assay


Eur J Med Chem 81: 89-94 (2014)


Article DOI: 10.1016/j.ejmech.2014.03.075
BindingDB Entry DOI: 10.7270/Q2VX0J3N
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50315563
PNG
(CHEMBL1088844 | {[(1S,2S,5R)-5-methyl-2-(propan-2-...)
Show SMILES CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1P(=O)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H29OP/c1-17(2)21-15-14-18(3)16-22(21)24(23,19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,17-18,21-22H,14-16H2,1-3H3/t18-,21+,22+/m1/s1
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n/an/a 500n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 ion channel after 3 mins by high-throughput planar patch clamp assay


ACS Med Chem Lett 3: 769-773 (2012)


Article DOI: 10.1021/ml3001787
BindingDB Entry DOI: 10.7270/Q2ST7QXG
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50123508
PNG
(CHEMBL148159 | [2'-(2-Pyridin-2-yl-ethylcarbamoyl)...)
Show SMILES O=C(NCc1ccccc1-c1ccccc1C(=O)NCCc1ccccn1)OCc1ccccc1
Show InChI InChI=1S/C29H27N3O3/c33-28(31-19-17-24-13-8-9-18-30-24)27-16-7-6-15-26(27)25-14-5-4-12-23(25)20-32-29(34)35-21-22-10-2-1-3-11-22/h1-16,18H,17,19-21H2,(H,31,33)(H,32,34)
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n/an/a 700n/an/an/an/an/an/a



Aventis Pharma Deutschland GmbH

Curated by ChEMBL


Assay Description
Inhibition of human voltage-gated potassium channel subunit Kv1.5 expressed in Xenopus oocytes


J Med Chem 46: 486-98 (2003)


Article DOI: 10.1021/jm0210461
BindingDB Entry DOI: 10.7270/Q2RJ4HTF
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50123519
PNG
(2'-{[2-(4-Methoxy-phenyl)-acetylamino]-methyl}-bip...)
Show SMILES COc1ccc(CC(=O)NCc2ccccc2-c2ccccc2C(=O)NCc2ccc(F)cc2F)cc1
Show InChI InChI=1S/C30H26F2N2O3/c1-37-24-14-10-20(11-15-24)16-29(35)33-18-21-6-2-3-7-25(21)26-8-4-5-9-27(26)30(36)34-19-22-12-13-23(31)17-28(22)32/h2-15,17H,16,18-19H2,1H3,(H,33,35)(H,34,36)
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n/an/a 1.20E+3n/an/an/an/an/an/a



Aventis Pharma Deutschland GmbH

Curated by ChEMBL


Assay Description
Inhibition of human voltage-gated potassium channel subunit Kv1.5 expressed in Xenopus oocytes


J Med Chem 46: 486-98 (2003)


Article DOI: 10.1021/jm0210461
BindingDB Entry DOI: 10.7270/Q2RJ4HTF
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50146383
PNG
(CHEMBL94764 | N-Benzyl-2-(toluene-4-sulfonylamino)...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1ccccc1C(=O)NCc1ccccc1
Show InChI InChI=1S/C21H20N2O3S/c1-16-11-13-18(14-12-16)27(25,26)23-20-10-6-5-9-19(20)21(24)22-15-17-7-3-2-4-8-17/h2-14,23H,15H2,1H3,(H,22,24)
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n/an/a 4.10E+3n/an/an/an/an/an/a



Aventis Pharma Deutschland GmbH

Curated by ChEMBL


Assay Description
Inhibitory effect against human voltage-gated potassium channel subunit Kv1.5 expressed in Xenopus oocytes


Bioorg Med Chem Lett 14: 2823-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.057
BindingDB Entry DOI: 10.7270/Q2RR1XPJ
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50146384
PNG
(CHEMBL314328 | N-Phenethyl-2-(toluene-4-sulfonylam...)
Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1ccccc1C(=O)NCCc1ccccc1
Show InChI InChI=1S/C22H22N2O3S/c1-17-11-13-19(14-12-17)28(26,27)24-21-10-6-5-9-20(21)22(25)23-16-15-18-7-3-2-4-8-18/h2-14,24H,15-16H2,1H3,(H,23,25)
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n/an/a 6.70E+3n/an/an/an/an/an/a



Aventis Pharma Deutschland GmbH

Curated by ChEMBL


Assay Description
Inhibitory effect against human voltage-gated potassium channel subunit Kv1.5 expressed in Xenopus oocytes


Bioorg Med Chem Lett 14: 2823-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.057
BindingDB Entry DOI: 10.7270/Q2RR1XPJ
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50146389
PNG
(CHEMBL97646 | N-(1-Phenyl-ethyl)-2-(toluene-4-sulf...)
Show SMILES CC(NC(=O)c1ccccc1NS(=O)(=O)c1ccc(C)cc1)c1ccccc1
Show InChI InChI=1S/C22H22N2O3S/c1-16-12-14-19(15-13-16)28(26,27)24-21-11-7-6-10-20(21)22(25)23-17(2)18-8-4-3-5-9-18/h3-15,17,24H,1-2H3,(H,23,25)
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n/an/a 3.20E+3n/an/an/an/an/an/a



Aventis Pharma Deutschland GmbH

Curated by ChEMBL


Assay Description
Inhibitory effect against human voltage-gated potassium channel subunit Kv1.5 expressed in Xenopus oocytes


Bioorg Med Chem Lett 14: 2823-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.03.057
BindingDB Entry DOI: 10.7270/Q2RR1XPJ
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50000778
PNG
((nifedipine) 2,6-Dimethyl-4-(2-nitro-phenyl)-1,4-d...)
Show SMILES COC([O-])=C1C(C(C(=[OH+])OC)=C(C)N=C1C)c1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C17H18N2O6/c1-9-13(16(20)24-3)15(14(10(2)18-9)17(21)25-4)11-7-5-6-8-12(11)19(22)23/h5-8,15,20H,1-4H3
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n/an/a 6.10E+3n/an/an/an/an/an/a



Bristol-Myers Squibb

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells by EP voltage clamp technique


Bioorg Med Chem Lett 18: 6381-5 (2008)


Article DOI: 10.1016/j.bmcl.2008.10.099
BindingDB Entry DOI: 10.7270/Q2WW7HH7
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50315563
PNG
(CHEMBL1088844 | {[(1S,2S,5R)-5-methyl-2-(propan-2-...)
Show SMILES CC(C)[C@@H]1CC[C@@H](C)C[C@@H]1P(=O)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H29OP/c1-17(2)21-15-14-18(3)16-22(21)24(23,19-10-6-4-7-11-19)20-12-8-5-9-13-20/h4-13,17-18,21-22H,14-16H2,1-3H3/t18-,21+,22+/m1/s1
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n/an/a 30n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in CHO cells by whole cell patch clamp assay


Bioorg Med Chem Lett 20: 2493-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.005
BindingDB Entry DOI: 10.7270/Q2T153SV
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50315565
PNG
(2-morpholino-2-phenylethanol | CHEMBL1090791)
Show SMILES OCC(N1CCOCC1)c1ccccc1
Show InChI InChI=1S/C12H17NO2/c14-10-12(11-4-2-1-3-5-11)13-6-8-15-9-7-13/h1-5,12,14H,6-10H2
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n/an/a>6.00E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in CHO cells by whole cell patch clamp assay


Bioorg Med Chem Lett 20: 2493-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.03.005
BindingDB Entry DOI: 10.7270/Q2T153SV
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50279106
PNG
(4-(4-phenoxybutoxy)-7H-furo[3,2-g]chromen-7-one | ...)
Show SMILES O=c1ccc2c(OCCCCOc3ccccc3)c3ccoc3cc2o1
Show InChI InChI=1S/C21H18O5/c22-20-9-8-16-19(26-20)14-18-17(10-13-24-18)21(16)25-12-5-4-11-23-15-6-2-1-3-7-15/h1-3,6-10,13-14H,4-5,11-12H2
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n/an/a 3.45E+3n/an/an/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 ion channel expressed in CHO K1 cells


Bioorg Med Chem Lett 20: 6989-92 (2010)


Article DOI: 10.1016/j.bmcl.2010.09.131
BindingDB Entry DOI: 10.7270/Q2HD7VW2
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50349984
PNG
(CHEMBL1813048)
Show SMILES CC(=O)Nc1cccc(Nc2ncnc(n2)N2CCC(CC2)OCc2ccc(OC(F)(F)F)cc2)c1C
Show InChI InChI=1S/C25H27F3N6O3/c1-16-21(31-17(2)35)4-3-5-22(16)32-23-29-15-30-24(33-23)34-12-10-19(11-13-34)36-14-18-6-8-20(9-7-18)37-25(26,27)28/h3-9,15,19H,10-14H2,1-2H3,(H,31,35)(H,29,30,32,33)
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n/an/a>3.33E+4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


J Med Chem 54: 4427-45 (2011)


Article DOI: 10.1021/jm200018k
BindingDB Entry DOI: 10.7270/Q2N016W1
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50001786
PNG
(1-(2-{4-[5-chloro-1-(4-fluorophenyl)-1H-indol-3-yl...)
Show SMILES Fc1ccc(cc1)-n1cc(C2CCN(CCN3CCNC3=O)CC2)c2cc(Cl)ccc12
Show InChI InChI=1S/C24H26ClFN4O/c25-18-1-6-23-21(15-18)22(16-30(23)20-4-2-19(26)3-5-20)17-7-10-28(11-8-17)13-14-29-12-9-27-24(29)31/h1-6,15-17H,7-14H2,(H,27,31)
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n/an/a 2.00E+3n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Inhibition of voltage-gated potassium channel subunit Kv1.5


J Med Chem 44: 1627-53 (2001)


Article DOI: 10.1021/jm000484+
BindingDB Entry DOI: 10.7270/Q218376D
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50017662
PNG
(2-(Diethylamino)-2',6'-acetoxylidide | 2-(Diethyla...)
Show SMILES CCN(CC)CC(=O)Nc1c(C)cccc1C
Show InChI InChI=1S/C14H22N2O/c1-5-16(6-2)10-13(17)15-14-11(3)8-7-9-12(14)4/h7-9H,5-6,10H2,1-4H3,(H,15,17)
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n/an/a 2.19E+6n/an/an/an/an/an/a



Cardiome Pharma Corporation

Curated by ChEMBL


Assay Description
Inhibition of human potassium channel Kv1.5 by patch-clamp method


J Med Chem 50: 2818-41 (2007)


Article DOI: 10.1021/jm0604528
BindingDB Entry DOI: 10.7270/Q29Z95QZ
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50131434
PNG
(CHEMBL652 | FLECAINIDE | N-(piperidin-2-ylmethyl)-...)
Show SMILES FC(F)(F)COc1ccc(OCC(F)(F)F)c(c1)C(=O)NCC1CCCCN1
Show InChI InChI=1S/C17H20F6N2O3/c18-16(19,20)9-27-12-4-5-14(28-10-17(21,22)23)13(7-12)15(26)25-8-11-3-1-2-6-24-11/h4-5,7,11,24H,1-3,6,8-10H2,(H,25,26)
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n/an/a 5.10E+4n/an/an/an/an/an/a



Cardiome Pharma Corporation

Curated by ChEMBL


Assay Description
Inhibition of human potassium channel Kv1.5 by patch-clamp method


J Med Chem 50: 2818-41 (2007)


Article DOI: 10.1021/jm0604528
BindingDB Entry DOI: 10.7270/Q29Z95QZ
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50067880
PNG
(4-methoxy-7H-furo[3,2-g][1]benzopyran-7-one | 4-me...)
Show SMILES COc1c2ccoc2cc2oc(=O)ccc12
Show InChI InChI=1S/C12H8O4/c1-14-12-7-2-3-11(13)16-10(7)6-9-8(12)4-5-15-9/h2-6H,1H3
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n/an/an/a 1.77E+5n/an/an/an/an/a



University of Kiel

Curated by ChEMBL


Assay Description
Blockade of peak K+ currents against Kv1.5 gene


J Med Chem 41: 4542-9 (1998)


Article DOI: 10.1021/jm981032o
BindingDB Entry DOI: 10.7270/Q2B56HWK
More data for this
Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 50000778,50001786,50017662,50067880,50123508,50123519,50131434,50146383,50146384,50146389,50151864,50279106,50315565,50315563,50349984
Cell (A)Syringe (B)Cell
Links
Syringe
Links
Cell + Syr
Links
ΔG°
kcal/mole
-TΔS°
kcal/mole
ΔH°
kcal/mole
log KpHTemp
°C
BDBM197280
JPEG
BDBM50017662
JPEG
PC cid
PC sid
CHEBI
DrugBank
KEGG
MMDB
PC cid
PC sid
PDB
-6.07n/an/a4.417.4024.9



University of California San Diego





J Comput Aided Mol Des 26: 475-87 (2012)