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PubMed code 18374568

Compile data set for download or QSAR
Found 14 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
Potassium voltage-gated channel subfamily A member 5


(Homo sapiens (Human))		BDBM50376745
PNG
(CHEMBL260684)
Show SMILES CCc1ccc(cc1)S(=O)(=O)N[C@H]1CCCc2ccc(cc12)N(Cc1cccc(C)n1)C(=O)CCc1ccccc1
Show InChI InChI=1S/C34H37N3O3S/c1-3-26-15-20-31(21-16-26)41(39,40)36-33-14-8-12-28-18-19-30(23-32(28)33)37(24-29-13-7-9-25(2)35-29)34(38)22-17-27-10-5-4-6-11-27/h4-7,9-11,13,15-16,18-21,23,33,36H,3,8,12,14,17,22,24H2,1-2H3/t33-/m0/s1
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n/an/a 46n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells assessed as blockade of ultra rapidly activating potassium current by volatge clamp t...

Bioorg Med Chem Lett 18: 2714-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.026
BindingDB Entry DOI: 10.7270/Q2QC04DZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5


(Homo sapiens (Human))		BDBM50099581
PNG
(CHEMBL288131 | N-((2R,3R)-3-(4-ethylphenylsulfonam...)
Show SMILES CCc1ccc(cc1)S(=O)(=O)N[C@H]1[C@H](O)Cc2ccc(NC(=O)c3cccc(OC)c3)cc12 |r|
Show InChI InChI=1S/C25H26N2O5S/c1-3-16-7-11-21(12-8-16)33(30,31)27-24-22-15-19(10-9-17(22)14-23(24)28)26-25(29)18-5-4-6-20(13-18)32-2/h4-13,15,23-24,27-28H,3,14H2,1-2H3,(H,26,29)/t23-,24-/m1/s1
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n/an/a 50n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells assessed as blockade of ultra rapidly activating potassium current by volatge clamp t...

Bioorg Med Chem Lett 18: 2714-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.026
BindingDB Entry DOI: 10.7270/Q2QC04DZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5


(Homo sapiens (Human))		BDBM50211535
PNG
(CHEMBL387993 | N-((3S,4R)-6-((S)-2-((2,6-dimethylp...)
Show SMILES CCc1ccc(cc1)S(=O)(=O)N[C@H]1[C@H](O)C(C)(C)Oc2ccc(cc12)C(=O)N1CCC[C@H]1CNc1c(C)cccc1C
Show InChI InChI=1S/C33H41N3O5S/c1-6-23-12-15-26(16-13-23)42(39,40)35-30-27-19-24(14-17-28(27)41-33(4,5)31(30)37)32(38)36-18-8-11-25(36)20-34-29-21(2)9-7-10-22(29)3/h7,9-10,12-17,19,25,30-31,34-35,37H,6,8,11,18,20H2,1-5H3/t25-,30+,31-/m0/s1
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n/an/a 60n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells assessed as blockade of ultra rapidly activating potassium current by volatge clamp t...

Bioorg Med Chem Lett 18: 2714-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.026
BindingDB Entry DOI: 10.7270/Q2QC04DZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5


(Homo sapiens (Human))		BDBM50211541
PNG
((3S,4R)-N-(2-fluorobenzyl)-N-ethyl-4-(4-ethylpheny...)
Show SMILES CCN(Cc1ccccc1F)C(=O)c1ccc2OC(C)(C)[C@@H](O)[C@H](NS(=O)(=O)c3ccc(CC)cc3)c2c1
Show InChI InChI=1S/C29H33FN2O5S/c1-5-19-11-14-22(15-12-19)38(35,36)31-26-23-17-20(13-16-25(23)37-29(3,4)27(26)33)28(34)32(6-2)18-21-9-7-8-10-24(21)30/h7-17,26-27,31,33H,5-6,18H2,1-4H3/t26-,27+/m1/s1
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n/an/a 172n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells assessed as blockade of ultra rapidly activating potassium current by volatge clamp t...

Bioorg Med Chem Lett 18: 2714-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.026
BindingDB Entry DOI: 10.7270/Q2QC04DZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5


(Homo sapiens (Human))		BDBM50211530
PNG
((3S,4R)-4-(4-ethylphenylsulfonamido)-3-hydroxy-N,2...)
Show SMILES CCc1ccc(cc1)S(=O)(=O)N[C@H]1[C@H](O)C(C)(C)Oc2ccc(cc12)C(=O)N(C)c1ccccc1
Show InChI InChI=1S/C27H30N2O5S/c1-5-18-11-14-21(15-12-18)35(32,33)28-24-22-17-19(13-16-23(22)34-27(2,3)25(24)30)26(31)29(4)20-9-7-6-8-10-20/h6-17,24-25,28,30H,5H2,1-4H3/t24-,25+/m1/s1
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n/an/a 281n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells assessed as blockade of ultra rapidly activating potassium current by volatge clamp t...

Bioorg Med Chem Lett 18: 2714-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.026
BindingDB Entry DOI: 10.7270/Q2QC04DZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5


(Homo sapiens (Human))		BDBM50376744
PNG
(CHEMBL259118)
Show SMILES CCc1ccc(cc1)S(=O)(=O)N[C@H]1[C@H](O)C(C)(C)Oc2ccc(cc12)C(=O)Nc1ccc(Br)cc1
Show InChI InChI=1S/C26H27BrN2O5S/c1-4-16-5-12-20(13-6-16)35(32,33)29-23-21-15-17(7-14-22(21)34-26(2,3)24(23)30)25(31)28-19-10-8-18(27)9-11-19/h5-15,23-24,29-30H,4H2,1-3H3,(H,28,31)/t23-,24+/m1/s1
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n/an/a 316n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells assessed as blockade of ultra rapidly activating potassium current by volatge clamp t...

Bioorg Med Chem Lett 18: 2714-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.026
BindingDB Entry DOI: 10.7270/Q2QC04DZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5


(Homo sapiens (Human))		BDBM50376739
PNG
(CHEMBL406415)
Show SMILES CCN(C(=O)c1cnc2OC(C)(C)[C@@H](O)[C@H](NS(=O)(=O)c3ccc(CC)cc3)c2c1)c1ccccc1
Show InChI InChI=1S/C27H31N3O5S/c1-5-18-12-14-21(15-13-18)36(33,34)29-23-22-16-19(17-28-25(22)35-27(3,4)24(23)31)26(32)30(6-2)20-10-8-7-9-11-20/h7-17,23-24,29,31H,5-6H2,1-4H3/t23-,24+/m1/s1
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n/an/a 378n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells assessed as blockade of ultra rapidly activating potassium current by volatge clamp t...

Bioorg Med Chem Lett 18: 2714-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.026
BindingDB Entry DOI: 10.7270/Q2QC04DZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5


(Homo sapiens (Human))		BDBM50376743
PNG
(CHEMBL259666)
Show SMILES CCN(Cc1ccc(OC)cc1)C(=O)c1cnc2OC(C)(C)[C@@H](O)[C@H](NS(=O)(=O)c3ccc(CC)cc3)c2c1
Show InChI InChI=1S/C29H35N3O6S/c1-6-19-10-14-23(15-11-19)39(35,36)31-25-24-16-21(17-30-27(24)38-29(3,4)26(25)33)28(34)32(7-2)18-20-8-12-22(37-5)13-9-20/h8-17,25-26,31,33H,6-7,18H2,1-5H3/t25-,26+/m1/s1
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n/an/a 605n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells assessed as blockade of ultra rapidly activating potassium current by volatge clamp t...

Bioorg Med Chem Lett 18: 2714-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.026
BindingDB Entry DOI: 10.7270/Q2QC04DZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5


(Homo sapiens (Human))		BDBM50376742
PNG
(CHEMBL258934)
Show SMILES CCN(Cc1c(F)cccc1Cl)C(=O)c1cnc2OC(C)(C)[C@@H](O)[C@H](NS(=O)(=O)c3ccc(CC)cc3)c2c1
Show InChI InChI=1S/C28H31ClFN3O5S/c1-5-17-10-12-19(13-11-17)39(36,37)32-24-20-14-18(15-31-26(20)38-28(3,4)25(24)34)27(35)33(6-2)16-21-22(29)8-7-9-23(21)30/h7-15,24-25,32,34H,5-6,16H2,1-4H3/t24-,25+/m1/s1
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n/an/a 615n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells assessed as blockade of ultra rapidly activating potassium current by volatge clamp t...

Bioorg Med Chem Lett 18: 2714-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.026
BindingDB Entry DOI: 10.7270/Q2QC04DZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5


(Homo sapiens (Human))		BDBM50376738
PNG
(CHEMBL407161)
Show SMILES CCN(C(=O)c1cnc2OC(C)(C)[C@@H](O)[C@H](NS(=O)(=O)c3ccc(CC)cc3)c2c1)c1cccc(Cl)c1
Show InChI InChI=1S/C27H30ClN3O5S/c1-5-17-10-12-21(13-11-17)37(34,35)30-23-22-14-18(16-29-25(22)36-27(3,4)24(23)32)26(33)31(6-2)20-9-7-8-19(28)15-20/h7-16,23-24,30,32H,5-6H2,1-4H3/t23-,24+/m1/s1
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n/an/a 649n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells assessed as blockade of ultra rapidly activating potassium current by volatge clamp t...

Bioorg Med Chem Lett 18: 2714-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.026
BindingDB Entry DOI: 10.7270/Q2QC04DZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5


(Homo sapiens (Human))		BDBM50376737
PNG
(CHEMBL408935)
Show SMILES CCN(C(=O)c1cnc2OC(C)(C)[C@@H](O)[C@H](NS(=O)(=O)c3ccc(CC)cc3)c2c1)c1cccc(C)c1
Show InChI InChI=1S/C28H33N3O5S/c1-6-19-11-13-22(14-12-19)37(34,35)30-24-23-16-20(17-29-26(23)36-28(4,5)25(24)32)27(33)31(7-2)21-10-8-9-18(3)15-21/h8-17,24-25,30,32H,6-7H2,1-5H3/t24-,25+/m1/s1
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n/an/a 776n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells assessed as blockade of ultra rapidly activating potassium current by volatge clamp t...

Bioorg Med Chem Lett 18: 2714-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.026
BindingDB Entry DOI: 10.7270/Q2QC04DZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5


(Homo sapiens (Human))		BDBM50376746
PNG
(CHEMBL258802)
Show SMILES CCN(C(=O)c1cnc2OC(C)(C)[C@@H](O)[C@H](NS(=O)(=O)c3ccc(CC)cc3)c2c1)c1cc(F)ccc1F
Show InChI InChI=1S/C27H29F2N3O5S/c1-5-16-7-10-19(11-8-16)38(35,36)31-23-20-13-17(15-30-25(20)37-27(3,4)24(23)33)26(34)32(6-2)22-14-18(28)9-12-21(22)29/h7-15,23-24,31,33H,5-6H2,1-4H3/t23-,24+/m1/s1
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n/an/a 912n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells assessed as blockade of ultra rapidly activating potassium current by volatge clamp t...

Bioorg Med Chem Lett 18: 2714-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.026
BindingDB Entry DOI: 10.7270/Q2QC04DZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5


(Homo sapiens (Human))		BDBM50376741
PNG
(CHEMBL258719)
Show SMILES CCN(Cc1ccc(C)cc1)C(=O)c1cnc2OC(C)(C)[C@@H](O)[C@H](NS(=O)(=O)c3ccc(CC)cc3)c2c1
Show InChI InChI=1S/C29H35N3O5S/c1-6-20-12-14-23(15-13-20)38(35,36)31-25-24-16-22(17-30-27(24)37-29(4,5)26(25)33)28(34)32(7-2)18-21-10-8-19(3)9-11-21/h8-17,25-26,31,33H,6-7,18H2,1-5H3/t25-,26+/m1/s1
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n/an/a 1.56E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells assessed as blockade of ultra rapidly activating potassium current by volatge clamp t...

Bioorg Med Chem Lett 18: 2714-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.026
BindingDB Entry DOI: 10.7270/Q2QC04DZ
More data for this
Ligand-Target Pair
Potassium voltage-gated channel subfamily A member 5


(Homo sapiens (Human))		BDBM50376740
PNG
(CHEMBL258718)
Show SMILES CCN(Cc1ccccc1OC)C(=O)c1cnc2OC(C)(C)[C@@H](O)[C@H](NS(=O)(=O)c3ccc(CC)cc3)c2c1
Show InChI InChI=1S/C29H35N3O6S/c1-6-19-12-14-22(15-13-19)39(35,36)31-25-23-16-21(17-30-27(23)38-29(3,4)26(25)33)28(34)32(7-2)18-20-10-8-9-11-24(20)37-5/h8-17,25-26,31,33H,6-7,18H2,1-5H3/t25-,26+/m1/s1
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n/an/a 2.09E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of human Kv1.5 channel expressed in mouse L929 cells assessed as blockade of ultra rapidly activating potassium current by volatge clamp t...

Bioorg Med Chem Lett 18: 2714-8 (2008)


Article DOI: 10.1016/j.bmcl.2008.03.026
BindingDB Entry DOI: 10.7270/Q2QC04DZ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%