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Compile Data Set for Download or QSAR

Found 24 hits Enz. Inhib. hit(s) with Target = 'Glucose-6-phosphatase' AND taxid = 9606   
Target
(Institution)
LigandTarget
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
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103118
PNG
(CHEMBL66059 | N,N-Dibenzyl-N'-[1-(5-chloro-thiophe...)
Show SMILES Clc1ccc(\C=N\N(Cc2ccccc2)Cc2ccccc2)s1
Show InChI InChI=1S/C19H17ClN2S/c20-19-12-11-18(23-19)13-21-22(14-16-7-3-1-4-8-16)15-17-9-5-2-6-10-17/h1-13H,14-15H2/b21-13+
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n/an/a 170n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103125
PNG
(CHEMBL69115 | N,N-Dibenzyl-N'-[1-(4-methoxy-phenyl...)
Show SMILES COc1ccc(\C=N\N(Cc2ccccc2)Cc2ccccc2)cc1
Show InChI InChI=1S/C22H22N2O/c1-25-22-14-12-19(13-15-22)16-23-24(17-20-8-4-2-5-9-20)18-21-10-6-3-7-11-21/h2-16H,17-18H2,1H3/b23-16+
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n/an/a 220n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103111
PNG
(CHEMBL69665 | N,N-Dibenzyl-N'-[1-(4-chloro-phenyl)...)
Show SMILES Clc1ccc(\C=N\N(Cc2ccccc2)Cc2ccccc2)cc1
Show InChI InChI=1S/C21H19ClN2/c22-21-13-11-18(12-14-21)15-23-24(16-19-7-3-1-4-8-19)17-20-9-5-2-6-10-20/h1-15H,16-17H2/b23-15+
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n/an/a 240n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103119
PNG
(CHEMBL302504 | N,N-Dibenzyl-N'-[1-(5-ethyl-furan-2...)
Show SMILES CCc1ccc(\C=N\N(Cc2ccccc2)Cc2ccccc2)o1
Show InChI InChI=1S/C21H22N2O/c1-2-20-13-14-21(24-20)15-22-23(16-18-9-5-3-6-10-18)17-19-11-7-4-8-12-19/h3-15H,2,16-17H2,1H3/b22-15+
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n/an/a 330n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103107
PNG
(CHEMBL65842 | N,N-Dibenzyl-N'-[1-(3-methoxy-phenyl...)
Show SMILES COc1cccc(\C=N\N(Cc2ccccc2)Cc2ccccc2)c1
Show InChI InChI=1S/C22H22N2O/c1-25-22-14-8-13-21(15-22)16-23-24(17-19-9-4-2-5-10-19)18-20-11-6-3-7-12-20/h2-16H,17-18H2,1H3/b23-16+
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n/an/a 700n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103128
PNG
(CHEMBL68984 | N,N-Dibenzyl-N'-[1-furan-2-yl-meth-(...)
Show SMILES C(N(Cc1ccccc1)\N=C\c1ccco1)c1ccccc1
Show InChI InChI=1S/C19H18N2O/c1-3-8-17(9-4-1)15-21(16-18-10-5-2-6-11-18)20-14-19-12-7-13-22-19/h1-14H,15-16H2/b20-14+
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n/an/a 1.10E+3n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103106
PNG
(CHEMBL69480 | N,N-Dibenzyl-N'-[1-thiophen-2-yl-met...)
Show SMILES C(N(Cc1ccccc1)\N=C\c1cccs1)c1ccccc1
Show InChI InChI=1S/C19H18N2S/c1-3-8-17(9-4-1)15-21(16-18-10-5-2-6-11-18)20-14-19-12-7-13-22-19/h1-14H,15-16H2/b20-14+
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n/an/a 1.50E+3n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103122
PNG
(CHEMBL69334 | N,N-Dibenzyl-N'-[1-phenyl-meth-(E)-y...)
Show SMILES C(N(Cc1ccccc1)\N=C\c1ccccc1)c1ccccc1
Show InChI InChI=1S/C21H20N2/c1-4-10-19(11-5-1)16-22-23(17-20-12-6-2-7-13-20)18-21-14-8-3-9-15-21/h1-16H,17-18H2/b22-16+
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n/an/a 1.50E+3n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103110
PNG
(CHEMBL305258 | N,N-Dibenzyl-N'-[1-(3,4-dichloro-ph...)
Show SMILES Clc1ccc(\C=N\N(Cc2ccccc2)Cc2ccccc2)cc1Cl
Show InChI InChI=1S/C21H18Cl2N2/c22-20-12-11-19(13-21(20)23)14-24-25(15-17-7-3-1-4-8-17)16-18-9-5-2-6-10-18/h1-14H,15-16H2/b24-14+
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n/an/a 2.00E+3n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103114
PNG
(CHEMBL69541 | N,N-Dibenzyl-N'-[1-cyclohexyl-meth-(...)
Show SMILES C(N(Cc1ccccc1)N=CC1CCCCC1)c1ccccc1
Show InChI InChI=1S/C21H26N2/c1-4-10-19(11-5-1)16-22-23(17-20-12-6-2-7-13-20)18-21-14-8-3-9-15-21/h2-3,6-9,12-16,19H,1,4-5,10-11,17-18H2
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n/an/a 2.40E+3n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103115
PNG
(4-(Dibenzyl-hydrazonomethyl)-phenol | CHEMBL70032)
Show SMILES Oc1ccc(\C=N\N(Cc2ccccc2)Cc2ccccc2)cc1
Show InChI InChI=1S/C21H20N2O/c24-21-13-11-18(12-14-21)15-22-23(16-19-7-3-1-4-8-19)17-20-9-5-2-6-10-20/h1-15,24H,16-17H2/b22-15+
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n/an/a 2.40E+3n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103126
PNG
(CHEMBL68011 | N,N-Dibenzyl-N'-[1-pyridin-3-yl-meth...)
Show SMILES C(N(Cc1ccccc1)\N=C\c1cccnc1)c1ccccc1
Show InChI InChI=1S/C20H19N3/c1-3-8-18(9-4-1)16-23(17-19-10-5-2-6-11-19)22-15-20-12-7-13-21-14-20/h1-15H,16-17H2/b22-15+
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n/an/a 3.70E+3n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103120
PNG
(CHEMBL69497 | N,N-Dibenzyl-N'-[1-pyridin-2-yl-meth...)
Show SMILES C(N(Cc1ccccc1)\N=C\c1ccccn1)c1ccccc1
Show InChI InChI=1S/C20H19N3/c1-3-9-18(10-4-1)16-23(17-19-11-5-2-6-12-19)22-15-20-13-7-8-14-21-20/h1-15H,16-17H2/b22-15+
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n/an/a 1.00E+4n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103124
PNG
(CHEMBL67272 | [5-(Dibenzyl-hydrazonomethyl)-furan-...)
Show SMILES OCc1ccc(\C=N\N(Cc2ccccc2)Cc2ccccc2)o1
Show InChI InChI=1S/C20H20N2O2/c23-16-20-12-11-19(24-20)13-21-22(14-17-7-3-1-4-8-17)15-18-9-5-2-6-10-18/h1-13,23H,14-16H2/b21-13+
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n/an/a 1.60E+4n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103112
PNG
(CHEMBL71650 | N,N-Dibenzyl-N'-[1-pyridin-4-yl-meth...)
Show SMILES C(N(Cc1ccccc1)\N=C\c1ccncc1)c1ccccc1
Show InChI InChI=1S/C20H19N3/c1-3-7-19(8-4-1)16-23(17-20-9-5-2-6-10-20)22-15-18-11-13-21-14-12-18/h1-15H,16-17H2/b22-15+
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n/an/a 1.70E+4n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103121
PNG
(CHEMBL419070 | N,N-Dibenzyl-N'-[1-phenyl-eth-(E)-y...)
Show SMILES CC(=NN(Cc1ccccc1)Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H22N2/c1-19(22-15-9-4-10-16-22)23-24(17-20-11-5-2-6-12-20)18-21-13-7-3-8-14-21/h2-16H,17-18H2,1H3
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n/an/a 2.50E+4n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103109
PNG
(CHEMBL66774 | N,N-Dibenzyl-N'-[3,4-dihydro-2H-naph...)
Show SMILES C(N(Cc1ccccc1)N=C1CCCc2ccccc12)c1ccccc1
Show InChI InChI=1S/C24H24N2/c1-3-10-20(11-4-1)18-26(19-21-12-5-2-6-13-21)25-24-17-9-15-22-14-7-8-16-23(22)24/h1-8,10-14,16H,9,15,17-19H2
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n/an/a 2.50E+4n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103116
PNG
(CHEMBL68981 | N,N-Dibenzyl-N'-[6-methoxy-3,4-dihyd...)
Show SMILES COc1ccc2C(CCCc2c1)=NN(Cc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C25H26N2O/c1-28-23-15-16-24-22(17-23)13-8-14-25(24)26-27(18-20-9-4-2-5-10-20)19-21-11-6-3-7-12-21/h2-7,9-12,15-17H,8,13-14,18-19H2,1H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50277824
PNG
(4'-Amino-4-fluoro-2'',4''-dimethoxy-6'-methylsulfa...)
Show SMILES COc1ccc(c(OC)c1)-c1c(C#N)c(N)c(C#N)c(SC)c1-c1ccc(F)cc1
Show InChI InChI=1S/C23H18FN3O2S/c1-28-15-8-9-16(19(10-15)29-2)21-17(11-25)22(27)18(12-26)23(30-3)20(21)13-4-6-14(24)7-5-13/h4-10H,27H2,1-3H3
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n/an/a 7.90E+4n/an/an/an/an/an/a



Central Drug Research Institute

Curated by ChEMBL


Assay Description
Inhibition of glucose-6-phosphatase (unknown origin)


Bioorg Med Chem Lett 19: 2158-61 (2009)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103108
PNG
(CHEMBL304503 | N,N-Dibenzyl-N'-[1-(2-methoxy-pheny...)
Show SMILES COc1ccccc1\C=N\N(Cc1ccccc1)Cc1ccccc1
Show InChI InChI=1S/C22H22N2O/c1-25-22-15-9-8-14-21(22)16-23-24(17-19-10-4-2-5-11-19)18-20-12-6-3-7-13-20/h2-16H,17-18H2,1H3/b23-16+
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n/an/a>1.00E+5n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103117
PNG
(CHEMBL302496 | N,N-Dibenzyl-N'-[1-(3,5-dichloro-ph...)
Show SMILES Clc1cc(Cl)cc(\C=N\N(Cc2ccccc2)Cc2ccccc2)c1
Show InChI InChI=1S/C21H18Cl2N2/c22-20-11-19(12-21(23)13-20)14-24-25(15-17-7-3-1-4-8-17)16-18-9-5-2-6-10-18/h1-14H,15-16H2/b24-14+
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n/an/a>1.00E+5n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103127
PNG
(CHEMBL69742 | N,N-Dibenzyl-N'-[1-(5-nitro-furan-2-...)
Show SMILES [O-][N+](=O)c1ccc([CH-]N=[N+](Cc2ccccc2)Cc2ccccc2)o1
Show InChI InChI=1S/C19H17N3O3/c23-22(24)19-12-11-18(25-19)13-20-21(14-16-7-3-1-4-8-16)15-17-9-5-2-6-10-17/h1-13H,14-15H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103113
PNG
(CHEMBL69758 | [4-(Dibenzyl-hydrazonomethyl)-phenyl...)
Show SMILES CN(C)c1ccc(\C=N\N(Cc2ccccc2)Cc2ccccc2)cc1
Show InChI InChI=1S/C23H25N3/c1-25(2)23-15-13-20(14-16-23)17-24-26(18-21-9-5-3-6-10-21)19-22-11-7-4-8-12-22/h3-17H,18-19H2,1-2H3/b24-17+
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n/an/a 1.00E+5n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair
Glucose-6-phosphatase


(Homo sapiens)
BDBM50103123
PNG
(CHEMBL68153 | N,N-Dibenzyl-N'-[2-phenyl-eth-(E)-yl...)
Show SMILES C(C=NN(Cc1ccccc1)Cc1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H22N2/c1-4-10-20(11-5-1)16-17-23-24(18-21-12-6-2-7-13-21)19-22-14-8-3-9-15-22/h1-15,17H,16,18-19H2
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n/an/a>1.00E+5n/an/an/an/an/an/a



Novo Nordisk A/S

Curated by ChEMBL


Assay Description
Compound was evaluated for inhibition of Glucose-6-Phosphatase from Triton X-100 disrupted pig liver microsomes.


Bioorg Med Chem Lett 11: 2165-7 (2001)

More data for this
Ligand-Target Pair