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PubMed code 16949818

Compile data set for download or QSAR
Found 41 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 Kv1.5


(Homo sapiens (Human))
BDBM50194539
PNG
(4-(3-(2-fluorophenyl)propanamido)-N,N-diisopropyl-...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)CCc1ccccc1F)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C30H36FN3O2/c1-21(2)34(22(3)4)30(36)29(25-14-10-18-32-19-25)26(23-11-6-5-7-12-23)20-33-28(35)17-16-24-13-8-9-15-27(24)31/h5-15,18-19,21-22,26,29H,16-17,20H2,1-4H3,(H,33,35)
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n/an/a 36n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194512
PNG
(CHEMBL216955 | N,N-diisopropyl-3-phenyl-4-(3-pheny...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)CC(C)c1ccccc1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C31H39N3O2/c1-22(2)34(23(3)4)31(36)30(27-17-12-18-32-20-27)28(26-15-10-7-11-16-26)21-33-29(35)19-24(5)25-13-8-6-9-14-25/h6-18,20,22-24,28,30H,19,21H2,1-5H3,(H,33,35)
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n/an/a 94n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194549
PNG
(CHEMBL217222 | N,N-diisopropyl-3-phenyl-4-(3-pheny...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)CCc1ccccc1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C30H37N3O2/c1-22(2)33(23(3)4)30(35)29(26-16-11-19-31-20-26)27(25-14-9-6-10-15-25)21-32-28(34)18-17-24-12-7-5-8-13-24/h5-16,19-20,22-23,27,29H,17-18,21H2,1-4H3,(H,32,34)
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n/an/a 100n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194510
PNG
(CHEMBL386441 | methyl 5-(diisopropylamino)-3-(3-(3...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1cccnc1)c1cccc(c1)-c1c(C)noc1C
Show InChI InChI=1S/C28H35N3O4/c1-17(2)31(18(3)4)28(33)27(23-12-9-13-29-16-23)24(15-25(32)34-7)21-10-8-11-22(14-21)26-19(5)30-35-20(26)6/h8-14,16-18,24,27H,15H2,1-7H3
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n/an/a 113n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194540
PNG
(CHEMBL217011 | methyl 3-(3-bromophenyl)-5-(diisopr...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1cccnc1)c1cccc(Br)c1
Show InChI InChI=1S/C23H29BrN2O3/c1-15(2)26(16(3)4)23(28)22(18-9-7-11-25-14-18)20(13-21(27)29-5)17-8-6-10-19(24)12-17/h6-12,14-16,20,22H,13H2,1-5H3
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n/an/a 137n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194514
PNG
(CHEMBL217921 | methyl 4-(3-bromophenyl)-5-(diisopr...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1cccc(Br)c1)c1cccnc1
Show InChI InChI=1S/C23H29BrN2O3/c1-15(2)26(16(3)4)23(28)22(17-8-6-10-19(24)12-17)20(13-21(27)29-5)18-9-7-11-25-14-18/h6-12,14-16,20,22H,13H2,1-5H3
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n/an/a 147n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194527
PNG
(4-(3-(2-fluorobenzyl)ureido)-N,N-diisopropyl-3-phe...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)NCc1ccccc1F)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C29H35FN4O2/c1-20(2)34(21(3)4)28(35)27(24-14-10-16-31-17-24)25(22-11-6-5-7-12-22)19-33-29(36)32-18-23-13-8-9-15-26(23)30/h5-17,20-21,25,27H,18-19H2,1-4H3,(H2,32,33,36)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194517
PNG
(CHEMBL385737 | methyl 3-(3-cyanophenyl)-5-(diisopr...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1cccnc1)c1cccc(c1)C#N
Show InChI InChI=1S/C24H29N3O3/c1-16(2)27(17(3)4)24(29)23(20-10-7-11-26-15-20)21(13-22(28)30-5)19-9-6-8-18(12-19)14-25/h6-12,15-17,21,23H,13H2,1-5H3
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n/an/a 184n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194528
PNG
(CHEMBL411970 | methyl 3-(4-cyanophenyl)-5-(diisopr...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1cccnc1)c1ccc(cc1)C#N
Show InChI InChI=1S/C24H29N3O3/c1-16(2)27(17(3)4)24(29)23(20-7-6-12-26-15-20)21(13-22(28)30-5)19-10-8-18(14-25)9-11-19/h6-12,15-17,21,23H,13H2,1-5H3
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n/an/a 215n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194524
PNG
(CHEMBL217291 | N,N-diisopropyl-4-(3-(4-methylbenzy...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)NCc1ccc(C)cc1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C30H38N4O2/c1-21(2)34(22(3)4)29(35)28(26-12-9-17-31-19-26)27(25-10-7-6-8-11-25)20-33-30(36)32-18-24-15-13-23(5)14-16-24/h6-17,19,21-22,27-28H,18,20H2,1-5H3,(H2,32,33,36)
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n/an/a 240n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194544
PNG
(CHEMBL218128 | N1,N1-diisopropyl-3-phenyl-N5-(1-ph...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CC(=O)NC(C)c1ccccc1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C30H37N3O2/c1-21(2)33(22(3)4)30(35)29(26-17-12-18-31-20-26)27(25-15-10-7-11-16-25)19-28(34)32-23(5)24-13-8-6-9-14-24/h6-18,20-23,27,29H,19H2,1-5H3,(H,32,34)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194516
PNG
(CHEMBL217684 | N,N-diisopropyl-3-phenyl-4-(4-pheny...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)CCCc1ccccc1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C31H39N3O2/c1-23(2)34(24(3)4)31(36)30(27-18-12-20-32-21-27)28(26-16-9-6-10-17-26)22-33-29(35)19-11-15-25-13-7-5-8-14-25/h5-10,12-14,16-18,20-21,23-24,28,30H,11,15,19,22H2,1-4H3,(H,33,35)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194531
PNG
(CHEMBL216086 | methyl 5-(diisopropylamino)-5-oxo-3...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C24H31NO3/c1-17(2)25(18(3)4)24(27)23(20-14-10-7-11-15-20)21(16-22(26)28-5)19-12-8-6-9-13-19/h6-15,17-18,21,23H,16H2,1-5H3
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194547
PNG
(CHEMBL384780 | N,N-diisopropyl-4-(3-(3-methylbenzy...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)NCc1cccc(C)c1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C30H38N4O2/c1-21(2)34(22(3)4)29(35)28(26-15-10-16-31-19-26)27(25-13-7-6-8-14-25)20-33-30(36)32-18-24-12-9-11-23(5)17-24/h6-17,19,21-22,27-28H,18,20H2,1-5H3,(H2,32,33,36)
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n/an/a 252n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194513
PNG
(CHEMBL384095 | N,N-diisopropyl-4-(3-(4-methoxybenz...)
Show SMILES COc1ccc(CNC(=O)NCC(C(C(=O)N(C(C)C)C(C)C)c2cccnc2)c2ccccc2)cc1
Show InChI InChI=1S/C30H38N4O3/c1-21(2)34(22(3)4)29(35)28(25-12-9-17-31-19-25)27(24-10-7-6-8-11-24)20-33-30(36)32-18-23-13-15-26(37-5)16-14-23/h6-17,19,21-22,27-28H,18,20H2,1-5H3,(H2,32,33,36)
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194530
PNG
((3R,4S)-methyl 5-(diisopropylamino)-5-oxo-3-phenyl...)
Show SMILES COC(=O)C[C@H]([C@H](C(=O)N(C(C)C)C(C)C)c1cccnc1)c1ccccc1
Show InChI InChI=1S/C23H30N2O3/c1-16(2)25(17(3)4)23(27)22(19-12-9-13-24-15-19)20(14-21(26)28-5)18-10-7-6-8-11-18/h6-13,15-17,20,22H,14H2,1-5H3/t20-,22+/m0/s1
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Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194546
PNG
(CHEMBL384974 | methyl 5-(diisopropylamino)-5-oxo-4...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C23H30N2O3/c1-16(2)25(17(3)4)23(27)22(18-10-7-6-8-11-18)20(14-21(26)28-5)19-12-9-13-24-15-19/h6-13,15-17,20,22H,14H2,1-5H3
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Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194535
PNG
(CHEMBL216436 | N,N-diisopropyl-3-phenyl-4-(3-((R)-...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)N[C@H](C)c1ccccc1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C30H38N4O2/c1-21(2)34(22(3)4)29(35)28(26-17-12-18-31-19-26)27(25-15-10-7-11-16-25)20-32-30(36)33-23(5)24-13-8-6-9-14-24/h6-19,21-23,27-28H,20H2,1-5H3,(H2,32,33,36)/t23-,27?,28?/m1/s1
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n/an/a 283n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194541
PNG
(CHEMBL385960 | N,N-diisopropyl-4-(3-phenethylureid...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)NCCc1ccccc1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C30H38N4O2/c1-22(2)34(23(3)4)29(35)28(26-16-11-18-31-20-26)27(25-14-9-6-10-15-25)21-33-30(36)32-19-17-24-12-7-5-8-13-24/h5-16,18,20,22-23,27-28H,17,19,21H2,1-4H3,(H2,32,33,36)
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Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194521
PNG
(CHEMBL386226 | methyl 4-(3-cyanophenyl)-5-(diisopr...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1cccc(c1)C#N)c1cccnc1
Show InChI InChI=1S/C24H29N3O3/c1-16(2)27(17(3)4)24(29)23(19-9-6-8-18(12-19)14-25)21(13-22(28)30-5)20-10-7-11-26-15-20/h6-12,15-17,21,23H,13H2,1-5H3
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n/an/a 326n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194526
PNG
(4-(3-(3-fluorobenzyl)ureido)-N,N-diisopropyl-3-phe...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)NCc1cccc(F)c1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C29H35FN4O2/c1-20(2)34(21(3)4)28(35)27(24-13-9-15-31-18-24)26(23-11-6-5-7-12-23)19-33-29(36)32-17-22-10-8-14-25(30)16-22/h5-16,18,20-21,26-27H,17,19H2,1-4H3,(H2,32,33,36)
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n/an/a 341n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194523
PNG
(4-(3-(4-fluorobenzyl)ureido)-N,N-diisopropyl-3-phe...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)NCc1ccc(F)cc1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C29H35FN4O2/c1-20(2)34(21(3)4)28(35)27(24-11-8-16-31-18-24)26(23-9-6-5-7-10-23)19-33-29(36)32-17-22-12-14-25(30)15-13-22/h5-16,18,20-21,26-27H,17,19H2,1-4H3,(H2,32,33,36)
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n/an/a 353n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194536
PNG
(4-(3-(4-bromobenzyl)ureido)-N,N-diisopropyl-3-phen...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)NCc1ccc(Br)cc1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C29H35BrN4O2/c1-20(2)34(21(3)4)28(35)27(24-11-8-16-31-18-24)26(23-9-6-5-7-10-23)19-33-29(36)32-17-22-12-14-25(30)15-13-22/h5-16,18,20-21,26-27H,17,19H2,1-4H3,(H2,32,33,36)
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n/an/a 362n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194543
PNG
(CHEMBL384706 | N1,N1-diisopropyl-N5-phenethyl-3-ph...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CC(=O)NCCc1ccccc1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C30H37N3O2/c1-22(2)33(23(3)4)30(35)29(26-16-11-18-31-21-26)27(25-14-9-6-10-15-25)20-28(34)32-19-17-24-12-7-5-8-13-24/h5-16,18,21-23,27,29H,17,19-20H2,1-4H3,(H,32,34)
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n/an/a 410n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194548
PNG
(CHEMBL217251 | N5-(2-fluorobenzyl)-N1,N1-diisoprop...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CC(=O)NCc1ccccc1F)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C29H34FN3O2/c1-20(2)33(21(3)4)29(35)28(24-14-10-16-31-18-24)25(22-11-6-5-7-12-22)17-27(34)32-19-23-13-8-9-15-26(23)30/h5-16,18,20-21,25,28H,17,19H2,1-4H3,(H,32,34)
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n/an/a 432n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194529
PNG
(CHEMBL216254 | N,N-diisopropyl-3-phenyl-4-(3-((S)-...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)N[C@@H](C)c1ccccc1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C30H38N4O2/c1-21(2)34(22(3)4)29(35)28(26-17-12-18-31-19-26)27(25-15-10-7-11-16-25)20-32-30(36)33-23(5)24-13-8-6-9-14-24/h6-19,21-23,27-28H,20H2,1-5H3,(H2,32,33,36)/t23-,27?,28?/m0/s1
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n/an/a 490n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194533
PNG
(4-(3-(2-chlorophenyl)propanamido)-N,N-diisopropyl-...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)CCc1ccccc1Cl)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C30H36ClN3O2/c1-21(2)34(22(3)4)30(36)29(25-14-10-18-32-19-25)26(23-11-6-5-7-12-23)20-33-28(35)17-16-24-13-8-9-15-27(24)31/h5-15,18-19,21-22,26,29H,16-17,20H2,1-4H3,(H,33,35)
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n/an/a 498n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194545
PNG
(CHEMBL439539 | N1,N1-diisopropyl-3-phenyl-N5-(3-ph...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CC(=O)NCCCc1ccccc1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C31H39N3O2/c1-23(2)34(24(3)4)31(36)30(27-18-12-19-32-22-27)28(26-16-9-6-10-17-26)21-29(35)33-20-11-15-25-13-7-5-8-14-25/h5-10,12-14,16-19,22-24,28,30H,11,15,20-21H2,1-4H3,(H,33,35)
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n/an/a 589n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194538
PNG
(CHEMBL216310 | methyl 5-(diisopropylamino)-5-oxo-3...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1cccnc1)c1cccnc1
Show InChI InChI=1S/C22H29N3O3/c1-15(2)25(16(3)4)22(27)21(18-9-7-11-24-14-18)19(12-20(26)28-5)17-8-6-10-23-13-17/h6-11,13-16,19,21H,12H2,1-5H3
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n/an/a 708n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194515
PNG
(4-(3-(2-chlorobenzyl)ureido)-N,N-diisopropyl-3-phe...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)NCc1ccccc1Cl)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C29H35ClN4O2/c1-20(2)34(21(3)4)28(35)27(24-14-10-16-31-17-24)25(22-11-6-5-7-12-22)19-33-29(36)32-18-23-13-8-9-15-26(23)30/h5-17,20-21,25,27H,18-19H2,1-4H3,(H2,32,33,36)
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n/an/a 757n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194509
PNG
(4-(2-amino-3-(2-fluorophenyl)propanamido)-N,N-diis...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CNC(=O)C(N)Cc1ccccc1F)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C30H37FN4O2/c1-20(2)35(21(3)4)30(37)28(24-14-10-16-33-18-24)25(22-11-6-5-7-12-22)19-34-29(36)27(32)17-23-13-8-9-15-26(23)31/h5-16,18,20-21,25,27-28H,17,19,32H2,1-4H3,(H,34,36)
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n/an/a 1.31E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194534
PNG
(CHEMBL216338 | N5-(2-(tert-butylthio)ethyl)-N1,N1-...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CC(=O)NCCSC(C)(C)C)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C28H41N3O2S/c1-20(2)31(21(3)4)27(33)26(23-14-11-15-29-19-23)24(22-12-9-8-10-13-22)18-25(32)30-16-17-34-28(5,6)7/h8-15,19-21,24,26H,16-18H2,1-7H3,(H,30,32)
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n/an/a 1.59E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194519
PNG
(CHEMBL436956 | methyl 3-(2-cyanophenyl)-5-(diisopr...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1cccnc1)c1ccccc1C#N
Show InChI InChI=1S/C24H29N3O3/c1-16(2)27(17(3)4)24(29)23(19-10-8-12-26-15-19)21(13-22(28)30-5)20-11-7-6-9-18(20)14-25/h6-12,15-17,21,23H,13H2,1-5H3
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n/an/a 1.77E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194537
PNG
(CHEMBL217473 | N1,N1-diisopropyl-N5-methyl-3-pheny...)
Show SMILES CNC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1cccnc1)c1ccccc1
Show InChI InChI=1S/C23H31N3O2/c1-16(2)26(17(3)4)23(28)22(19-12-9-13-25-15-19)20(14-21(27)24-5)18-10-7-6-8-11-18/h6-13,15-17,20,22H,14H2,1-5H3,(H,24,27)
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n/an/a 2.67E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194520
PNG
(CHEMBL385920 | N1,N1-diisopropyl-3-phenyl-N5-((4-p...)
Show SMILES CC(C)N(C(C)C)C(=O)C(C(CC(=O)NCC1CN(CCO1)c1ccccc1)c1ccccc1)c1cccnc1
Show InChI InChI=1S/C33H42N4O3/c1-24(2)37(25(3)4)33(39)32(27-14-11-17-34-21-27)30(26-12-7-5-8-13-26)20-31(38)35-22-29-23-36(18-19-40-29)28-15-9-6-10-16-28/h5-17,21,24-25,29-30,32H,18-20,22-23H2,1-4H3,(H,35,38)
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n/an/a 3.38E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194511
PNG
((3S,4S)-methyl 5-(diisopropylamino)-5-oxo-3-phenyl...)
Show SMILES COC(=O)C[C@@H]([C@H](C(=O)N(C(C)C)C(C)C)c1cccnc1)c1ccccc1
Show InChI InChI=1S/C23H30N2O3/c1-16(2)25(17(3)4)23(27)22(19-12-9-13-24-15-19)20(14-21(26)28-5)18-10-7-6-8-11-18/h6-13,15-17,20,22H,14H2,1-5H3/t20-,22-/m1/s1
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n/an/a 3.70E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194532
PNG
(CHEMBL386899 | methyl 5-(diisopropylamino)-5-oxo-4...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1ccccn1)c1cccnc1
Show InChI InChI=1S/C22H29N3O3/c1-15(2)25(16(3)4)22(27)21(19-10-6-7-12-24-19)18(13-20(26)28-5)17-9-8-11-23-14-17/h6-12,14-16,18,21H,13H2,1-5H3
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n/an/a 3.84E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194542
PNG
(CHEMBL216255 | methyl 5-(diisopropylamino)-5-oxo-4...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1ccccc1)c1ccncc1
Show InChI InChI=1S/C23H30N2O3/c1-16(2)25(17(3)4)23(27)22(19-9-7-6-8-10-19)20(15-21(26)28-5)18-11-13-24-14-12-18/h6-14,16-17,20,22H,15H2,1-5H3
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n/an/a 5.32E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194522
PNG
(CHEMBL385460 | methyl 5-(diisopropylamino)-5-oxo-4...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1ccccc1)c1ccccn1
Show InChI InChI=1S/C23H30N2O3/c1-16(2)25(17(3)4)23(27)22(18-11-7-6-8-12-18)19(15-21(26)28-5)20-13-9-10-14-24-20/h6-14,16-17,19,22H,15H2,1-5H3
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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 6.35E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194518
PNG
(CHEMBL216309 | methyl 5-(diisopropylamino)-5-oxo-3...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1ccccn1)c1ccccc1
Show InChI InChI=1S/C23H30N2O3/c1-16(2)25(17(3)4)23(27)22(20-13-9-10-14-24-20)19(15-21(26)28-5)18-11-7-6-8-12-18/h6-14,16-17,19,22H,15H2,1-5H3
PDB

UniProtKB/SwissProt

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UniChem

Similars

Article
PubMed
n/an/a 6.87E+3n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
Voltage-gated potassium channel subunit Kv1.5


(Homo sapiens (Human))
BDBM50194525
PNG
(CHEMBL384309 | methyl 5-(diisopropylamino)-5-oxo-3...)
Show SMILES COC(=O)CC(C(C(=O)N(C(C)C)C(C)C)c1ccncc1)c1ccccc1
Show InChI InChI=1S/C23H30N2O3/c1-16(2)25(17(3)4)23(27)22(19-11-13-24-14-12-19)20(15-21(26)28-5)18-9-7-6-8-10-18/h6-14,16-17,20,22H,15H2,1-5H3
PDB

UniProtKB/SwissProt

GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 1.38E+4n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibition of Kv1.5


Bioorg Med Chem Lett 16: 5897-901 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.054
BindingDB Entry DOI: 10.7270/Q2Z60NP6
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%