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PubChem AID 449733

Compile data set for download or QSAR
Found 56 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
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM34452
PNG
((4-amino-3-phenyl-2-sulfanylidene-1,3-thiazol-5-yl...)
Show SMILES CN1CCN(CC1)C(=O)c1sc(=S)n(c1N)-c1ccccc1
Show InChI InChI=1S/C15H18N4OS2/c1-17-7-9-18(10-8-17)14(20)12-13(16)19(15(21)22-12)11-5-3-2-4-6-11/h2-6H,7-10,16H2,1H3
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n/an/a 921n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM34347
PNG
(MLS000056753 | SMR000066372 | [4-amino-3-(3-methyl...)
Show SMILES CN1CCN(CC1)C(=O)c1sc(=S)n(c1N)-c1cccc(C)c1
Show InChI InChI=1S/C16H20N4OS2/c1-11-4-3-5-12(10-11)20-14(17)13(23-16(20)22)15(21)19-8-6-18(2)7-9-19/h3-5,10H,6-9,17H2,1-2H3
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n/an/a 4.43E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM34452
PNG
((4-amino-3-phenyl-2-sulfanylidene-1,3-thiazol-5-yl...)
Show SMILES CN1CCN(CC1)C(=O)c1sc(=S)n(c1N)-c1ccccc1
Show InChI InChI=1S/C15H18N4OS2/c1-17-7-9-18(10-8-17)14(20)12-13(16)19(15(21)22-12)11-5-3-2-4-6-11/h2-6H,7-10,16H2,1H3
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n/an/a 4.82E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75366
PNG
(1-cyclopentyl-3-(4-sulfamoylphenyl)thiourea | MLS-...)
Show SMILES NS(=O)(=O)c1ccc(NC(=S)NC2CCCC2)cc1
Show InChI InChI=1S/C12H17N3O2S2/c13-19(16,17)11-7-5-10(6-8-11)15-12(18)14-9-3-1-2-4-9/h5-9H,1-4H2,(H2,13,16,17)(H2,14,15,18)
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n/an/a 5.31E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM34347
PNG
(MLS000056753 | SMR000066372 | [4-amino-3-(3-methyl...)
Show SMILES CN1CCN(CC1)C(=O)c1sc(=S)n(c1N)-c1cccc(C)c1
Show InChI InChI=1S/C16H20N4OS2/c1-11-4-3-5-12(10-11)20-14(17)13(23-16(20)22)15(21)19-8-6-18(2)7-9-19/h3-5,10H,6-9,17H2,1-2H3
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n/an/a 5.82E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75354
PNG
(2-chloranyl-3-[2-(6-chloranylpyridin-3-yl)-1,2,3,4...)
Show SMILES Clc1ccc(cn1)-n1nnc(n1)-c1cc2ccccc2nc1Cl
Show InChI InChI=1S/C15H8Cl2N6/c16-13-6-5-10(8-18-13)23-21-15(20-22-23)11-7-9-3-1-2-4-12(9)19-14(11)17/h1-8H
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n/an/a 6.22E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75351
PNG
(2-chloranyl-3-[2-(6-chloranylpyridin-3-yl)-1,2,3,4...)
Show SMILES Clc1ccc(cn1)-n1nnc(n1)-c1cccnc1Cl
Show InChI InChI=1S/C11H6Cl2N6/c12-9-4-3-7(6-15-9)19-17-11(16-18-19)8-2-1-5-14-10(8)13/h1-6H
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n/an/a 9.73E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75349
PNG
((3E)-6-methoxy-3-[2-(4-methylphenyl)-1H-1,2,3,4-te...)
Show SMILES COc1ccc2nc(O)c(cc2c1)-c1nnn(n1)-c1ccc(C)cc1
Show InChI InChI=1S/C18H15N5O2/c1-11-3-5-13(6-4-11)23-21-17(20-22-23)15-10-12-9-14(25-2)7-8-16(12)19-18(15)24/h3-10H,1-2H3,(H,19,24)
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n/an/a 1.19E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75368
PNG
(1-(2,3-dihydro-1H-inden-5-yl)-3-(4-sulfamoylphenyl...)
Show SMILES NS(=O)(=O)c1ccc(NC(=S)Nc2ccc3CCCc3c2)cc1
Show InChI InChI=1S/C16H17N3O2S2/c17-23(20,21)15-8-6-13(7-9-15)18-16(22)19-14-5-4-11-2-1-3-12(11)10-14/h4-10H,1-3H2,(H2,17,20,21)(H2,18,19,22)
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n/an/a 1.21E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75339
PNG
((3E)-3-[2-(3,4-dichlorophenyl)-1H-1,2,3,4-tetrazol...)
Show SMILES COc1ccc2nc(O)c(cc2c1)-c1nnn(n1)-c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C17H11Cl2N5O2/c1-26-11-3-5-15-9(6-11)7-12(17(25)20-15)16-21-23-24(22-16)10-2-4-13(18)14(19)8-10/h2-8H,1H3,(H,20,25)
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n/an/a 1.29E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75348
PNG
(2-chloranyl-3-[2-(4-methylphenyl)-1,2,3,4-tetrazol...)
Show SMILES Cc1ccc(cc1)-n1nnc(n1)-c1cc2ccccc2nc1Cl
Show InChI InChI=1S/C17H12ClN5/c1-11-6-8-13(9-7-11)23-21-17(20-22-23)14-10-12-4-2-3-5-15(12)19-16(14)18/h2-10H,1H3
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n/an/a 2.01E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75365
PNG
(1-phenyl-3-(4-sulfamoylphenyl)thiourea | MLS-04356...)
Show SMILES NS(=O)(=O)c1ccc(NC(=S)Nc2ccccc2)cc1
Show InChI InChI=1S/C13H13N3O2S2/c14-20(17,18)12-8-6-11(7-9-12)16-13(19)15-10-4-2-1-3-5-10/h1-9H,(H2,14,17,18)(H2,15,16,19)
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n/an/a 3.28E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75356
PNG
(MLS-0435606.0001 | [4-amino-3-(2-methylphenyl)-2-s...)
Show SMILES Cc1ccccc1-n1c(N)c(sc1=S)C(=O)N1CCOCC1
Show InChI InChI=1S/C15H17N3O2S2/c1-10-4-2-3-5-11(10)18-13(16)12(22-15(18)21)14(19)17-6-8-20-9-7-17/h2-5H,6-9,16H2,1H3
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n/an/a 3.38E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75358
PNG
(MLS-0435608.0001 | [4-amino-3-(2,5-dimethylphenyl)...)
Show SMILES Cc1ccc(C)c(c1)-n1c(N)c(sc1=S)C(=O)N1CCCCC1
Show InChI InChI=1S/C17H21N3OS2/c1-11-6-7-12(2)13(10-11)20-15(18)14(23-17(20)22)16(21)19-8-4-3-5-9-19/h6-7,10H,3-5,8-9,18H2,1-2H3
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n/an/a 3.40E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75361
PNG
(4-amino-3-(2-fluoro-5-methyl-phenyl)-N-(p-tolyl)-2...)
Show SMILES Cc1ccc(NC(=O)c2sc(=S)n(c2N)-c2cc(C)ccc2F)cc1
Show InChI InChI=1S/C18H16FN3OS2/c1-10-3-6-12(7-4-10)21-17(23)15-16(20)22(18(24)25-15)14-9-11(2)5-8-13(14)19/h3-9H,20H2,1-2H3,(H,21,23)
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n/an/a 3.79E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75335
PNG
(2-chloranyl-3-[2-(3,4-dichlorophenyl)-1,2,3,4-tetr...)
Show SMILES Clc1ccc(cc1Cl)-n1nnc(n1)-c1cccnc1Cl
Show InChI InChI=1S/C12H6Cl3N5/c13-9-4-3-7(6-10(9)14)20-18-12(17-19-20)8-2-1-5-16-11(8)15/h1-6H
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n/an/a 5.31E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75357
PNG
(MLS-0435607.0001 | [4-amino-3-(5-chloro-2-methoxy-...)
Show SMILES COc1ccc(Cl)cc1-n1c(N)c(sc1=S)C(=O)N1CCOCC1
Show InChI InChI=1S/C15H16ClN3O3S2/c1-21-11-3-2-9(16)8-10(11)19-13(17)12(24-15(19)23)14(20)18-4-6-22-7-5-18/h2-3,8H,4-7,17H2,1H3
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n/an/a 5.95E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75360
PNG
(4-amino-3-(3,4-dimethylphenyl)-N-(2-fluorophenyl)-...)
Show SMILES Cc1ccc(cc1C)-n1c(N)c(sc1=S)C(=O)Nc1ccccc1F
Show InChI InChI=1S/C18H16FN3OS2/c1-10-7-8-12(9-11(10)2)22-16(20)15(25-18(22)24)17(23)21-14-6-4-3-5-13(14)19/h3-9H,20H2,1-2H3,(H,21,23)
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n/an/a 6.62E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM66495
PNG
((3E)-6-methoxy-3-(2-phenyl-1H-1,2,3,4-tetrazol-5-y...)
Show SMILES COc1ccc2nc(O)c(cc2c1)-c1nnn(n1)-c1ccccc1
Show InChI InChI=1S/C17H13N5O2/c1-24-13-7-8-15-11(9-13)10-14(17(23)18-15)16-19-21-22(20-16)12-5-3-2-4-6-12/h2-10H,1H3,(H,18,23)
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n/an/a 6.68E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75355
PNG
((3E)-3-[2-(6-chloranylpyridin-3-yl)-1H-1,2,3,4-tet...)
Show SMILES COc1ccc2nc(O)c(cc2c1)-c1nnn(n1)-c1ccc(Cl)nc1
Show InChI InChI=1S/C16H11ClN6O2/c1-25-11-3-4-13-9(6-11)7-12(16(24)19-13)15-20-22-23(21-15)10-2-5-14(17)18-8-10/h2-8H,1H3,(H,19,24)
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n/an/a 6.88E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75350
PNG
(2-chloranyl-5-[5-(2-methoxypyridin-3-yl)-1,2,3,4-t...)
Show SMILES COc1ncccc1-c1nnn(n1)-c1ccc(Cl)nc1
Show InChI InChI=1S/C12H9ClN6O/c1-20-12-9(3-2-6-14-12)11-16-18-19(17-11)8-4-5-10(13)15-7-8/h2-7H,1H3
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n/an/a 7.31E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75371
PNG
(1-(4-methylphenyl)-3-(4-sulfamoylphenyl)urea | 1-(...)
Show SMILES Cc1ccc(NC(=O)Nc2ccc(cc2)S(N)(=O)=O)cc1
Show InChI InChI=1S/C14H15N3O3S/c1-10-2-4-11(5-3-10)16-14(18)17-12-6-8-13(9-7-12)21(15,19)20/h2-9H,1H3,(H2,15,19,20)(H2,16,17,18)
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n/an/a 7.38E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75346
PNG
(3-[2-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]pyridi...)
Show SMILES Cc1ccc(cc1)-n1nnc(n1)-c1cccnc1
Show InChI InChI=1S/C13H11N5/c1-10-4-6-12(7-5-10)18-16-13(15-17-18)11-3-2-8-14-9-11/h2-9H,1H3
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n/an/a 8.28E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75370
PNG
(1-(4-sulfamoylphenyl)-3-(1,2,3,4-tetrahydronaphtha...)
Show SMILES NS(=O)(=O)c1ccc(NC(=S)NC2CCCc3ccccc23)cc1
Show InChI InChI=1S/C17H19N3O2S2/c18-24(21,22)14-10-8-13(9-11-14)19-17(23)20-16-7-3-5-12-4-1-2-6-15(12)16/h1-2,4,6,8-11,16H,3,5,7H2,(H2,18,21,22)(H2,19,20,23)
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n/an/a 9.20E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75352
PNG
(2-chloranyl-5-(5-pyridin-3-yl-1,2,3,4-tetrazol-2-y...)
Show SMILES Clc1ccc(cn1)-n1nnc(n1)-c1cccnc1
Show InChI InChI=1S/C11H7ClN6/c12-10-4-3-9(7-14-10)18-16-11(15-17-18)8-2-1-5-13-6-8/h1-7H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75362
PNG
(MLS-0435627.0001 | [4-amino-3-(4-methylphenyl)-2-s...)
Show SMILES Cc1ccc(cc1)-n1c(N)c(sc1=S)C(=O)N1CCN(CC1)c1ccccc1F
Show InChI InChI=1S/C21H21FN4OS2/c1-14-6-8-15(9-7-14)26-19(23)18(29-21(26)28)20(27)25-12-10-24(11-13-25)17-5-3-2-4-16(17)22/h2-9H,10-13,23H2,1H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM46209
PNG
(1-cyclopropyl-3-(4-sulfamoylphenyl)thiourea | MLS-...)
Show SMILES NS(=O)(=O)c1ccc(NC(=S)NC2CC2)cc1
Show InChI InChI=1S/C10H13N3O2S2/c11-17(14,15)9-5-3-8(4-6-9)13-10(16)12-7-1-2-7/h3-7H,1-2H2,(H2,11,14,15)(H2,12,13,16)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75340
PNG
(3-[2-(4-fluorophenyl)-1,2,3,4-tetrazol-5-yl]-2-met...)
Show SMILES COc1ncccc1-c1nnn(n1)-c1ccc(F)cc1
Show InChI InChI=1S/C13H10FN5O/c1-20-13-11(3-2-8-15-13)12-16-18-19(17-12)10-6-4-9(14)5-7-10/h2-8H,1H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM49719
PNG
(2-chloranyl-3-[2-(4-fluorophenyl)-1,2,3,4-tetrazol...)
Show SMILES Fc1ccc(cc1)-n1nnc(n1)-c1cccnc1Cl
Show InChI InChI=1S/C12H7ClFN5/c13-11-10(2-1-7-15-11)12-16-18-19(17-12)9-5-3-8(14)4-6-9/h1-7H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM49721
PNG
(2-chloranyl-3-[2-(4-methylphenyl)-1,2,3,4-tetrazol...)
Show SMILES Cc1ccc(cc1)-n1nnc(n1)-c1cccnc1Cl
Show InChI InChI=1S/C13H10ClN5/c1-9-4-6-10(7-5-9)19-17-13(16-18-19)11-3-2-8-15-12(11)14/h2-8H,1H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75338
PNG
(2-chloranyl-3-[2-(3,4-dichlorophenyl)-1,2,3,4-tetr...)
Show SMILES Clc1ccc(cc1Cl)-n1nnc(n1)-c1cc2ccccc2nc1Cl
Show InChI InChI=1S/C16H8Cl3N5/c17-12-6-5-10(8-13(12)18)24-22-16(21-23-24)11-7-9-3-1-2-4-14(9)20-15(11)19/h1-8H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75333
PNG
(2-chloranyl-3-(2-phenyl-1,2,3,4-tetrazol-5-yl)quin...)
Show SMILES Clc1nc2ccccc2cc1-c1nnn(n1)-c1ccccc1
Show InChI InChI=1S/C16H10ClN5/c17-15-13(10-11-6-4-5-9-14(11)18-15)16-19-21-22(20-16)12-7-2-1-3-8-12/h1-10H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75332
PNG
(3-(2-phenyl-1,2,3,4-tetrazol-5-yl)quinoline | 3-(2...)
Show SMILES c1ccc(cc1)-n1nnc(n1)-c1cnc2ccccc2c1
Show InChI InChI=1S/C16H11N5/c1-2-7-14(8-3-1)21-19-16(18-20-21)13-10-12-6-4-5-9-15(12)17-11-13/h1-11H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75364
PNG
(4-(phenylmethyl)-N-(4-sulfamoylphenyl)-1-piperazin...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)N2CCN(Cc3ccccc3)CC2)cc1
Show InChI InChI=1S/C18H22N4O3S/c19-26(24,25)17-8-6-16(7-9-17)20-18(23)22-12-10-21(11-13-22)14-15-4-2-1-3-5-15/h1-9H,10-14H2,(H,20,23)(H2,19,24,25)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75347
PNG
(3-[2-(4-methylphenyl)-1,2,3,4-tetrazol-5-yl]quinol...)
Show SMILES Cc1ccc(cc1)-n1nnc(n1)-c1cnc2ccccc2c1
Show InChI InChI=1S/C17H13N5/c1-12-6-8-15(9-7-12)22-20-17(19-21-22)14-10-13-4-2-3-5-16(13)18-11-14/h2-11H,1H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75367
PNG
(1-cyclohexyl-3-[4-(ethylsulfamoyl)phenyl]thiourea ...)
Show SMILES CCNS(=O)(=O)c1ccc(NC(=S)NC2CCCCC2)cc1
Show InChI InChI=1S/C15H23N3O2S2/c1-2-16-22(19,20)14-10-8-13(9-11-14)18-15(21)17-12-6-4-3-5-7-12/h8-12,16H,2-7H2,1H3,(H2,17,18,21)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75344
PNG
((3E)-3-[2-(4-fluorophenyl)-1H-1,2,3,4-tetrazol-5-y...)
Show SMILES COc1ccc2nc(O)c(cc2c1)-c1nnn(n1)-c1ccc(F)cc1
Show InChI InChI=1S/C17H12FN5O2/c1-25-13-6-7-15-10(8-13)9-14(17(24)19-15)16-20-22-23(21-16)12-4-2-11(18)3-5-12/h2-9H,1H3,(H,19,24)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM46211
PNG
(1-cyclohexyl-3-(4-sulfamoylphenyl)thiourea | MLS-0...)
Show SMILES NS(=O)(=O)c1ccc(NC(=S)NC2CCCCC2)cc1
Show InChI InChI=1S/C13H19N3O2S2/c14-20(17,18)12-8-6-11(7-9-12)16-13(19)15-10-4-2-1-3-5-10/h6-10H,1-5H2,(H2,14,17,18)(H2,15,16,19)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM46210
PNG
(4-(1,3-benzodioxol-5-ylmethyl)-N-(4-sulfamoylpheny...)
Show SMILES NS(=O)(=O)c1ccc(NC(=S)N2CCN(Cc3ccc4OCOc4c3)CC2)cc1
Show InChI InChI=1S/C19H22N4O4S2/c20-29(24,25)16-4-2-15(3-5-16)21-19(28)23-9-7-22(8-10-23)12-14-1-6-17-18(11-14)27-13-26-17/h1-6,11H,7-10,12-13H2,(H,21,28)(H2,20,24,25)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75336
PNG
(3-[2-(3,4-dichlorophenyl)-1,2,3,4-tetrazol-5-yl]py...)
Show SMILES Clc1ccc(cc1Cl)-n1nnc(n1)-c1cccnc1
Show InChI InChI=1S/C12H7Cl2N5/c13-10-4-3-9(6-11(10)14)19-17-12(16-18-19)8-2-1-5-15-7-8/h1-7H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75353
PNG
(3-[2-(6-chloranylpyridin-3-yl)-1,2,3,4-tetrazol-5-...)
Show SMILES Clc1ccc(cn1)-n1nnc(n1)-c1cnc2ccccc2c1
Show InChI InChI=1S/C15H9ClN6/c16-14-6-5-12(9-18-14)22-20-15(19-21-22)11-7-10-3-1-2-4-13(10)17-8-11/h1-9H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75343
PNG
(2-chloranyl-3-[2-(4-fluorophenyl)-1,2,3,4-tetrazol...)
Show SMILES Fc1ccc(cc1)-n1nnc(n1)-c1cc2ccccc2nc1Cl
Show InChI InChI=1S/C16H9ClFN5/c17-15-13(9-10-3-1-2-4-14(10)19-15)16-20-22-23(21-16)12-7-5-11(18)6-8-12/h1-9H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75359
PNG
(MLS-0435609.0001 | [4-amino-3-(3-chloro-4-fluoro-p...)
Show SMILES Nc1c(sc(=S)n1-c1ccc(F)c(Cl)c1)C(=O)N1CCOCC1
Show InChI InChI=1S/C14H13ClFN3O2S2/c15-9-7-8(1-2-10(9)16)19-12(17)11(23-14(19)22)13(20)18-3-5-21-6-4-18/h1-2,7H,3-6,17H2
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75363
PNG
(4-(3-pyridinylmethyl)-N-(4-sulfamoylphenyl)-1-pipe...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)N2CCN(Cc3cccnc3)CC2)cc1
Show InChI InChI=1S/C17H21N5O3S/c18-26(24,25)16-5-3-15(4-6-16)20-17(23)22-10-8-21(9-11-22)13-14-2-1-7-19-12-14/h1-7,12H,8-11,13H2,(H,20,23)(H2,18,24,25)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM34347
PNG
(MLS000056753 | SMR000066372 | [4-amino-3-(3-methyl...)
Show SMILES CN1CCN(CC1)C(=O)c1sc(=S)n(c1N)-c1cccc(C)c1
Show InChI InChI=1S/C16H20N4OS2/c1-11-4-3-5-12(10-11)20-14(17)13(23-16(20)22)15(21)19-8-6-18(2)7-9-19/h3-5,10H,6-9,17H2,1-2H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75331
PNG
(3-(2-phenyl-1,2,3,4-tetrazol-5-yl)pyridine | 3-(2-...)
Show SMILES c1ccc(cc1)-n1nnc(n1)-c1cccnc1
Show InChI InChI=1S/C12H9N5/c1-2-6-11(7-3-1)17-15-12(14-16-17)10-5-4-8-13-9-10/h1-9H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75334
PNG
(3-[2-(3,4-dichlorophenyl)-1,2,3,4-tetrazol-5-yl]-2...)
Show SMILES COc1ncccc1-c1nnn(n1)-c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C13H9Cl2N5O/c1-21-13-9(3-2-6-16-13)12-17-19-20(18-12)8-4-5-10(14)11(15)7-8/h2-7H,1H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75372
PNG
(1-(3-methylphenyl)-3-(4-sulfamoylphenyl)thiourea |...)
Show SMILES Cc1cccc(NC(=S)Nc2ccc(cc2)S(N)(=O)=O)c1
Show InChI InChI=1S/C14H15N3O2S2/c1-10-3-2-4-12(9-10)17-14(20)16-11-5-7-13(8-6-11)21(15,18)19/h2-9H,1H3,(H2,15,18,19)(H2,16,17,20)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM49720
PNG
(2-chloranyl-3-(2-phenyl-1,2,3,4-tetrazol-5-yl)pyri...)
Show SMILES Clc1ncccc1-c1nnn(n1)-c1ccccc1
Show InChI InChI=1S/C12H8ClN5/c13-11-10(7-4-8-14-11)12-15-17-18(16-12)9-5-2-1-3-6-9/h1-8H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75337
PNG
(3-[2-(3,4-dichlorophenyl)-1,2,3,4-tetrazol-5-yl]qu...)
Show SMILES Clc1ccc(cc1Cl)-n1nnc(n1)-c1cnc2ccccc2c1
Show InChI InChI=1S/C16H9Cl2N5/c17-13-6-5-12(8-14(13)18)23-21-16(20-22-23)11-7-10-3-1-2-4-15(10)19-9-11/h1-9H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75345
PNG
(2-methoxy-3-[2-(4-methylphenyl)-1,2,3,4-tetrazol-5...)
Show SMILES COc1ncccc1-c1nnn(n1)-c1ccc(C)cc1
Show InChI InChI=1S/C14H13N5O/c1-10-5-7-11(8-6-10)19-17-13(16-18-19)12-4-3-9-15-14(12)20-2/h3-9H,1-2H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75341
PNG
(3-[2-(4-fluorophenyl)-1,2,3,4-tetrazol-5-yl]pyridi...)
Show SMILES Fc1ccc(cc1)-n1nnc(n1)-c1cccnc1
Show InChI InChI=1S/C12H8FN5/c13-10-3-5-11(6-4-10)18-16-12(15-17-18)9-2-1-7-14-8-9/h1-8H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75330
PNG
(2-methoxy-3-(2-phenyl-1,2,3,4-tetrazol-5-yl)pyridi...)
Show SMILES COc1ncccc1-c1nnn(n1)-c1ccccc1
Show InChI InChI=1S/C13H11N5O/c1-19-13-11(8-5-9-14-13)12-15-17-18(16-12)10-6-3-2-4-7-10/h2-9H,1H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75342
PNG
(3-[2-(4-fluorophenyl)-1,2,3,4-tetrazol-5-yl]quinol...)
Show SMILES Fc1ccc(cc1)-n1nnc(n1)-c1cnc2ccccc2c1
Show InChI InChI=1S/C16H10FN5/c17-13-5-7-14(8-6-13)22-20-16(19-21-22)12-9-11-3-1-2-4-15(11)18-10-12/h1-10H
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM75369
PNG
(1-(1-benzyl-4-piperidyl)-3-(4-sulfamoylphenyl)thio...)
Show SMILES NS(=O)(=O)c1ccc(NC(=S)NC2CCN(Cc3ccccc3)CC2)cc1
Show InChI InChI=1S/C19H24N4O2S2/c20-27(24,25)18-8-6-16(7-9-18)21-19(26)22-17-10-12-23(13-11-17)14-15-4-2-1-3-5-15/h1-9,17H,10-14H2,(H2,20,24,25)(H2,21,22,26)
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM34452
PNG
((4-amino-3-phenyl-2-sulfanylidene-1,3-thiazol-5-yl...)
Show SMILES CN1CCN(CC1)C(=O)c1sc(=S)n(c1N)-c1ccccc1
Show InChI InChI=1S/C15H18N4OS2/c1-17-7-9-18(10-8-17)14(20)12-13(16)19(15(21)22-12)11-5-3-2-4-6-11/h2-6H,7-10,16H2,1H3
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Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Burnham Center for Chemical Genomics (BCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, CA) Networ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2GH9GDQ
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%