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PubMed code 19053830

Compile data set for download or QSAR
Found 5 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
Secreted frizzled-related protein 1


(Homo sapiens (Human))
BDBM50247135
PNG
(2-methyl-N-phenethyl-5-(phenylsulfonyl)benzenesulf...)
Show SMILES Cc1ccc(cc1S(=O)(=O)NCCc1ccccc1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C21H21NO4S2/c1-17-12-13-20(27(23,24)19-10-6-3-7-11-19)16-21(17)28(25,26)22-15-14-18-8-4-2-5-9-18/h2-13,16,22H,14-15H2,1H3
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n/an/an/an/a 3.88E+3n/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human sFRP1 expressed in human U2OS assessed as luciferase activity by TCF-luciferase reporter gene assay


J Med Chem 51: 7670-2 (2008)


Article DOI: 10.1021/jm801069w
BindingDB Entry DOI: 10.7270/Q2N58M6D
More data for this
Ligand-Target Pair
Secreted frizzled-related protein 1


(Homo sapiens (Human))
BDBM50246617
PNG
(2-Ethyl-5-(phenylsulfonyl)-N-(3-pyrrolidin-1-ylpro...)
Show SMILES CCc1ccc(cc1S(=O)(=O)NCCCN1CCCC1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C21H28N2O4S2/c1-2-18-11-12-20(28(24,25)19-9-4-3-5-10-19)17-21(18)29(26,27)22-13-8-16-23-14-6-7-15-23/h3-5,9-12,17,22H,2,6-8,13-16H2,1H3
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PubMed
n/an/an/an/a 9.00E+3n/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human sFRP1 expressed in human U2OS assessed as luciferase activity by TCF-luciferase reporter gene assay


J Med Chem 51: 7670-2 (2008)


Article DOI: 10.1021/jm801069w
BindingDB Entry DOI: 10.7270/Q2N58M6D
More data for this
Ligand-Target Pair
Secreted frizzled-related protein 1


(Homo sapiens (Human))
BDBM50246616
PNG
(CHEMBL473916 | N-[3-(Dimethylamino)propyl]-2-ethyl...)
Show SMILES CCc1ccc(cc1S(=O)(=O)NCCCN(C)C)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C19H26N2O4S2/c1-4-16-11-12-18(26(22,23)17-9-6-5-7-10-17)15-19(16)27(24,25)20-13-8-14-21(2)3/h5-7,9-12,15,20H,4,8,13-14H2,1-3H3
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n/an/an/an/a 1.27E+3n/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human sFRP1 expressed in human U2OS assessed as luciferase activity by TCF-luciferase reporter gene assay


J Med Chem 51: 7670-2 (2008)


Article DOI: 10.1021/jm801069w
BindingDB Entry DOI: 10.7270/Q2N58M6D
More data for this
Ligand-Target Pair
Secreted frizzled-related protein 1


(Homo sapiens (Human))
BDBM50247135
PNG
(2-methyl-N-phenethyl-5-(phenylsulfonyl)benzenesulf...)
Show SMILES Cc1ccc(cc1S(=O)(=O)NCCc1ccccc1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C21H21NO4S2/c1-17-12-13-20(27(23,24)19-10-6-3-7-11-19)16-21(17)28(25,26)22-15-14-18-8-4-2-5-9-18/h2-13,16,22H,14-15H2,1H3
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n/an/an/a 350n/an/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Binding affinity to human sFRP1 by flurescence spectroscopy


J Med Chem 51: 7670-2 (2008)


Article DOI: 10.1021/jm801069w
BindingDB Entry DOI: 10.7270/Q2N58M6D
More data for this
Ligand-Target Pair
Secreted frizzled-related protein 1


(Homo sapiens (Human))
BDBM50246651
PNG
(CHEMBL474926 | N-[2-(3,4-Dimethoxyphenyl)ethyl]-2-...)
Show SMILES CCc1ccc(cc1S(=O)(=O)NCCc1ccc(OC)c(OC)c1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C24H27NO6S2/c1-4-19-11-12-21(32(26,27)20-8-6-5-7-9-20)17-24(19)33(28,29)25-15-14-18-10-13-22(30-2)23(16-18)31-3/h5-13,16-17,25H,4,14-15H2,1-3H3
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PubMed
n/an/an/an/a 6.97E+3n/an/an/an/a



Wyeth Research

Curated by ChEMBL


Assay Description
Inhibition of human sFRP1 expressed in human U2OS assessed as luciferase activity by TCF-luciferase reporter gene assay


J Med Chem 51: 7670-2 (2008)


Article DOI: 10.1021/jm801069w
BindingDB Entry DOI: 10.7270/Q2N58M6D
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%