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Compile Data Set for Download or QSAR

Found 20 hits with Last Name = 'terry' and Initial = 'cm'   
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
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50119269
PNG
(CHEMBL102025 | Cyclobutyl-(7-fluoro-1,1-dioxo-1,4-...)
Show SMILES Fc1ccc2N=C(NC3CCC3)NS(=O)(=O)c2c1 |t:5|
Show InChI InChI=1S/C11H12FN3O2S/c12-7-4-5-9-10(6-7)18(16,17)15-11(14-9)13-8-2-1-3-8/h4-6,8H,1-3H2,(H2,13,14,15)
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n/an/an/an/a 356n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Inhibition of Beta-cell KATP channel

Bioorg Med Chem Lett 12: 2977-80 (2002)


BindingDB Entry DOI: 10.7270/Q20V8C4M
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50139704
PNG
(3-(2,4-Difluoro-phenyl)-4-nitro-5-trifluoromethyl-...)
Show SMILES [O-][N+](=O)c1c(n[nH]c1C(F)(F)F)-c1ccc(F)cc1F
Show InChI InChI=1S/C10H4F5N3O2/c11-4-1-2-5(6(12)3-4)7-8(18(19)20)9(17-16-7)10(13,14)15/h1-3H,(H,16,17)
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n/an/an/an/a 1.15E+3n/an/an/an/a



GlaxoSmithKline Research & Development

Curated by ChEMBL


Assay Description
Maximum activation of human KATP (SUR1/Kir6.2) channel expressed in Xenopus oocytes

Bioorg Med Chem Lett 14: 813-6 (2004)


BindingDB Entry DOI: 10.7270/Q29P312R
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50119271
PNG
(CHEMBL319521 | Cyclobutyl-(7-methoxy-1,1-dioxo-1,4...)
Show SMILES COc1ccc2N=C(NC3CCC3)NS(=O)(=O)c2c1 |t:6|
Show InChI InChI=1S/C12H15N3O3S/c1-18-9-5-6-10-11(7-9)19(16,17)15-12(14-10)13-8-3-2-4-8/h5-8H,2-4H2,1H3,(H2,13,14,15)
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n/an/an/an/a 4.00E+3n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Negative log EC50 for Beta-cell KATP channel

Bioorg Med Chem Lett 12: 2977-80 (2002)


BindingDB Entry DOI: 10.7270/Q20V8C4M
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50119270
PNG
(CHEMBL319596 | Cyclobutyl-(1,1-dioxo-1,4-dihydro-1...)
Show SMILES O=S1(=O)NC(NC2CCC2)=Nc2ccccc12 |c:10|
Show InChI InChI=1S/C11H13N3O2S/c15-17(16)10-7-2-1-6-9(10)13-11(14-17)12-8-4-3-5-8/h1-2,6-8H,3-5H2,(H2,12,13,14)
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n/an/an/an/a 2.00E+3n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Negative log EC50 for Beta-cell KATP channel

Bioorg Med Chem Lett 12: 2977-80 (2002)


BindingDB Entry DOI: 10.7270/Q20V8C4M
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50119274
PNG
(CHEMBL100793 | Cyclobutyl-(7-nitro-1,1-dioxo-1,4-d...)
Show SMILES [O-][N+](=O)c1ccc2[N-]\C(NS(=O)(=O)c2c1)=[NH+]\C1CCC1
Show InChI InChI=1S/C11H11N4O4S/c16-15(17)8-4-5-9-10(6-8)20(18,19)14-11(13-9)12-7-2-1-3-7/h4-7H,1-3H2,(H-,12,13,14)/q-1/p+1
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n/an/an/an/a 530n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Inhibition of Beta-cell KATP channel

Bioorg Med Chem Lett 12: 2977-80 (2002)


BindingDB Entry DOI: 10.7270/Q20V8C4M
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50119273
PNG
(CHEMBL101736 | N*3*-Cyclobutyl-1,1-dioxo-1,4-dihyd...)
Show SMILES Nc1ccc2N=C(NC3CCC3)NS(=O)(=O)c2c1 |t:5|
Show InChI InChI=1S/C11H14N4O2S/c12-7-4-5-9-10(6-7)18(16,17)15-11(14-9)13-8-2-1-3-8/h4-6,8H,1-3,12H2,(H2,13,14,15)
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n/an/an/an/a 3.10E+4n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Inhibition of Beta-cell KATP channel

Bioorg Med Chem Lett 12: 2977-80 (2002)


BindingDB Entry DOI: 10.7270/Q20V8C4M
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50119271
PNG
(CHEMBL319521 | Cyclobutyl-(7-methoxy-1,1-dioxo-1,4...)
Show SMILES COc1ccc2N=C(NC3CCC3)NS(=O)(=O)c2c1 |t:6|
Show InChI InChI=1S/C12H15N3O3S/c1-18-9-5-6-10-11(7-9)19(16,17)15-12(14-10)13-8-3-2-4-8/h5-8H,2-4H2,1H3,(H2,13,14,15)
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n/an/an/an/a 3.87E+3n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Inhibition of Beta-cell KATP channel

Bioorg Med Chem Lett 12: 2977-80 (2002)


BindingDB Entry DOI: 10.7270/Q20V8C4M
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM86248
PNG
(CAS_364-98-7 | NSC_3019 | diazoxide)
Show SMILES CC1=Nc2ccc(Cl)cc2S(=O)(=O)N1 |t:1|
Show InChI InChI=1S/C8H7ClN2O2S/c1-5-10-7-3-2-6(9)4-8(7)14(12,13)11-5/h2-4H,1H3,(H,10,11)
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n/an/an/an/a 8.80E+3n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Inhibition of Beta-cell KATP channel

Bioorg Med Chem Lett 12: 2977-80 (2002)


BindingDB Entry DOI: 10.7270/Q20V8C4M
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50119270
PNG
(CHEMBL319596 | Cyclobutyl-(1,1-dioxo-1,4-dihydro-1...)
Show SMILES O=S1(=O)NC(NC2CCC2)=Nc2ccccc12 |c:10|
Show InChI InChI=1S/C11H13N3O2S/c15-17(16)10-7-2-1-6-9(10)13-11(14-17)12-8-4-3-5-8/h1-2,6-8H,3-5H2,(H2,12,13,14)
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n/an/an/an/a 1.96E+3n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Inhibition of Beta-cell KATP channel

Bioorg Med Chem Lett 12: 2977-80 (2002)


BindingDB Entry DOI: 10.7270/Q20V8C4M
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50119272
PNG
((7-Chloro-1,1-dioxo-1,4-dihydro-1lambda*6*-benzo[1...)
Show SMILES Clc1ccc2N=C(NC3CCC3)NS(=O)(=O)c2c1 |t:5|
Show InChI InChI=1S/C11H12ClN3O2S/c12-7-4-5-9-10(6-7)18(16,17)15-11(14-9)13-8-2-1-3-8/h4-6,8H,1-3H2,(H2,13,14,15)
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n/an/an/an/a 196n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Inhibition of Beta-cell KATP channel

Bioorg Med Chem Lett 12: 2977-80 (2002)


BindingDB Entry DOI: 10.7270/Q20V8C4M
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50119272
PNG
((7-Chloro-1,1-dioxo-1,4-dihydro-1lambda*6*-benzo[1...)
Show SMILES Clc1ccc2N=C(NC3CCC3)NS(=O)(=O)c2c1 |t:5|
Show InChI InChI=1S/C11H12ClN3O2S/c12-7-4-5-9-10(6-7)18(16,17)15-11(14-9)13-8-2-1-3-8/h4-6,8H,1-3H2,(H2,13,14,15)
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n/an/an/an/a 200n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Negative log EC50 for Beta-cell KATP channel

Bioorg Med Chem Lett 12: 2977-80 (2002)


BindingDB Entry DOI: 10.7270/Q20V8C4M
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50119269
PNG
(CHEMBL102025 | Cyclobutyl-(7-fluoro-1,1-dioxo-1,4-...)
Show SMILES Fc1ccc2N=C(NC3CCC3)NS(=O)(=O)c2c1 |t:5|
Show InChI InChI=1S/C11H12FN3O2S/c12-7-4-5-9-10(6-7)18(16,17)15-11(14-9)13-8-2-1-3-8/h4-6,8H,1-3H2,(H2,13,14,15)
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n/an/an/an/a 400n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Negative log EC50 for Beta-cell KATP channel

Bioorg Med Chem Lett 12: 2977-80 (2002)


BindingDB Entry DOI: 10.7270/Q20V8C4M
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM86248
PNG
(CAS_364-98-7 | NSC_3019 | diazoxide)
Show SMILES CC1=Nc2ccc(Cl)cc2S(=O)(=O)N1 |t:1|
Show InChI InChI=1S/C8H7ClN2O2S/c1-5-10-7-3-2-6(9)4-8(7)14(12,13)11-5/h2-4H,1H3,(H,10,11)
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n/an/an/an/a 8.80E+3n/an/an/an/a



GlaxoSmithKline Research & Development

Curated by ChEMBL


Assay Description
Maximum activation of human KATP (SUR1/Kir6.2) channel expressed in Xenopus oocytes

Bioorg Med Chem Lett 14: 813-6 (2004)


BindingDB Entry DOI: 10.7270/Q29P312R
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50139705
PNG
(4-Nitro-3-(4-nitro-phenyl)-5-trifluoromethyl-1H-py...)
Show SMILES [O-][N+](=O)c1c(n[nH]c1C(F)(F)F)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C10H5F3N4O4/c11-10(12,13)9-8(17(20)21)7(14-15-9)5-1-3-6(4-2-5)16(18)19/h1-4H,(H,14,15)
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n/an/an/an/a 700n/an/an/an/a



GlaxoSmithKline Research & Development

Curated by ChEMBL


Assay Description
Maximum activation of human KATP (SUR1/Kir6.2) channel expressed in Xenopus oocytes

Bioorg Med Chem Lett 14: 813-6 (2004)


BindingDB Entry DOI: 10.7270/Q29P312R
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50139708
PNG
(3-(4-Nitro-phenyl)-5-trifluoromethyl-1H-pyrazole |...)
Show SMILES [O-][N+](=O)c1ccc(cc1)-c1cc([nH]n1)C(F)(F)F
Show InChI InChI=1S/C10H6F3N3O2/c11-10(12,13)9-5-8(14-15-9)6-1-3-7(4-2-6)16(17)18/h1-5H,(H,14,15)
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n/an/an/an/a>3.00E+4n/an/an/an/a



GlaxoSmithKline Research & Development

Curated by ChEMBL


Assay Description
Maximum activation of human KATP (SUR1/Kir6.2) channel expressed in Xenopus oocytes

Bioorg Med Chem Lett 14: 813-6 (2004)


BindingDB Entry DOI: 10.7270/Q29P312R
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50139710
PNG
(4-Nitro-3-phenyl-5-trifluoromethyl-1H-pyrazole | C...)
Show SMILES [O-][N+](=O)c1c(n[nH]c1C(F)(F)F)-c1ccccc1
Show InChI InChI=1S/C10H6F3N3O2/c11-10(12,13)9-8(16(17)18)7(14-15-9)6-4-2-1-3-5-6/h1-5H,(H,14,15)
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n/an/an/an/a 3.00E+4n/an/an/an/a



GlaxoSmithKline Research & Development

Curated by ChEMBL


Assay Description
Maximum activation of human KATP (SUR1/Kir6.2) channel expressed in Xenopus oocytes

Bioorg Med Chem Lett 14: 813-6 (2004)


BindingDB Entry DOI: 10.7270/Q29P312R
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50139709
PNG
(3-(2,4-Bis-trifluoromethyl-phenyl)-4-nitro-5-trifl...)
Show SMILES [O-][N+](=O)c1c(n[nH]c1C(F)(F)F)-c1ccc(cc1C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C12H4F9N3O2/c13-10(14,15)4-1-2-5(6(3-4)11(16,17)18)7-8(24(25)26)9(23-22-7)12(19,20)21/h1-3H,(H,22,23)
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n/an/an/an/a 540n/an/an/an/a



GlaxoSmithKline Research & Development

Curated by ChEMBL


Assay Description
Maximum activation of human KATP (SUR1/Kir6.2) channel expressed in Xenopus oocytes

Bioorg Med Chem Lett 14: 813-6 (2004)


BindingDB Entry DOI: 10.7270/Q29P312R
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50139707
PNG
(4-Nitro-3-(4-nitro-phenyl)-5-trifluoromethyl-isoxa...)
Show SMILES [O-][N+](=O)c1c([n-][o+]c1C(F)(F)F)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C10H4F3N3O5/c11-10(12,13)9-8(16(19)20)7(14-21-9)5-1-3-6(4-2-5)15(17)18/h1-4H
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n/an/an/an/a>3.00E+4n/an/an/an/a



GlaxoSmithKline Research & Development

Curated by ChEMBL


Assay Description
Maximum activation of human KATP (SUR1/Kir6.2) channel expressed in Xenopus oocytes

Bioorg Med Chem Lett 14: 813-6 (2004)


BindingDB Entry DOI: 10.7270/Q29P312R
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50139706
PNG
(3-(2,4-Dinitro-phenyl)-4-nitro-5-trifluoromethyl-1...)
Show SMILES [O-][N+](=O)c1c(n[nH]c1C(F)(F)F)-c1ccc(cc1[N+]([O-])=O)[N+]([O-])=O
Show InChI InChI=1S/C10H4F3N5O6/c11-10(12,13)9-8(18(23)24)7(14-15-9)5-2-1-4(16(19)20)3-6(5)17(21)22/h1-3H,(H,14,15)
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n/an/an/an/a 70n/an/an/an/a



GlaxoSmithKline Research & Development

Curated by ChEMBL


Assay Description
Maximum activation of human KATP (SUR1/Kir6.2) channel expressed in Xenopus oocytes

Bioorg Med Chem Lett 14: 813-6 (2004)


BindingDB Entry DOI: 10.7270/Q29P312R
More data for this
Ligand-Target Pair
ATP-binding cassette sub-family C member 8/ATP-sensitive inward rectifier potassium channel 11


(Homo sapiens (Human))		BDBM50119273
PNG
(CHEMBL101736 | N*3*-Cyclobutyl-1,1-dioxo-1,4-dihyd...)
Show SMILES Nc1ccc2N=C(NC3CCC3)NS(=O)(=O)c2c1 |t:5|
Show InChI InChI=1S/C11H14N4O2S/c12-7-4-5-9-10(6-7)18(16,17)15-11(14-9)13-8-2-1-3-8/h4-6,8H,1-3,12H2,(H2,13,14,15)
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n/an/an/an/a 3.20E+4n/an/an/an/a



GlaxoSmithKline Research and Development

Curated by ChEMBL


Assay Description
Negative log EC50 for Beta-cell KATP channel

Bioorg Med Chem Lett 12: 2977-80 (2002)


BindingDB Entry DOI: 10.7270/Q20V8C4M
More data for this
Ligand-Target Pair