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Compile Data Set for Download or QSAR

Found 1344 hits with Last Name = 'azimioara' and Initial = 'm'   
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
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM28764
PNG
(2-[3-chloro-4-(4-{[2-(2,4-dichlorophenoxy)ethyl]ca...)
Show SMILES OC(=O)Cc1ccc(-c2noc(c2C(=O)NCCOc2ccc(Cl)cc2Cl)-c2ccccc2)c(Cl)c1
Show InChI InChI=1S/C26H19Cl3N2O5/c27-17-7-9-21(20(29)14-17)35-11-10-30-26(34)23-24(31-36-25(23)16-4-2-1-3-5-16)18-8-6-15(12-19(18)28)13-22(32)33/h1-9,12,14H,10-11,13H2,(H,30,34)(H,32,33)
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n/an/an/an/a 80n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM28765
PNG
(2-{3-chloro-4-[(4-{[2-(2,4-dichlorophenoxy)ethyl]c...)
Show SMILES OC(=O)Cc1ccc(OCc2noc(c2C(=O)NCCOc2ccc(Cl)cc2Cl)-c2ccccc2)c(Cl)c1
Show InChI InChI=1S/C27H21Cl3N2O6/c28-18-7-9-22(20(30)14-18)36-11-10-31-27(35)25-21(32-38-26(25)17-4-2-1-3-5-17)15-37-23-8-6-16(12-19(23)29)13-24(33)34/h1-9,12,14H,10-11,13,15H2,(H,31,35)(H,33,34)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM28766
PNG
(2-[4-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES OC(=O)Cc1ccc(cc1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C26H20Cl2N2O5/c27-19-10-11-21(20(28)15-19)34-13-12-29-26(33)23-24(17-8-6-16(7-9-17)14-22(31)32)30-35-25(23)18-4-2-1-3-5-18/h1-11,15H,12-14H2,(H,29,33)(H,31,32)
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n/an/an/an/a 720n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM28767
PNG
(4-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-5-p...)
Show SMILES OC(=O)c1ccc(cc1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C25H18Cl2N2O5/c26-18-10-11-20(19(27)14-18)33-13-12-28-24(30)21-22(15-6-8-17(9-7-15)25(31)32)29-34-23(21)16-4-2-1-3-5-16/h1-11,14H,12-13H2,(H,28,30)(H,31,32)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM28768
PNG
(2-[4-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES Cc1cc(ccc1OCC(O)=O)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C27H22Cl2N2O6/c1-16-13-18(7-9-21(16)36-15-23(32)33)25-24(26(37-31-25)17-5-3-2-4-6-17)27(34)30-11-12-35-22-10-8-19(28)14-20(22)29/h2-10,13-14H,11-12,15H2,1H3,(H,30,34)(H,32,33)
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n/an/an/an/a 200n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM28769
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES OC(=O)Cc1cccc(c1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C26H20Cl2N2O5/c27-19-9-10-21(20(28)15-19)34-12-11-29-26(33)23-24(18-8-4-5-16(13-18)14-22(31)32)30-35-25(23)17-6-2-1-3-7-17/h1-10,13,15H,11-12,14H2,(H,29,33)(H,31,32)
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n/an/an/an/a 70n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM28770
PNG
(3-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES OC(=O)CCc1cccc(c1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C27H22Cl2N2O5/c28-20-10-11-22(21(29)16-20)35-14-13-30-27(34)24-25(31-36-26(24)18-6-2-1-3-7-18)19-8-4-5-17(15-19)9-12-23(32)33/h1-8,10-11,15-16H,9,12-14H2,(H,30,34)(H,32,33)
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n/an/an/an/a 970n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM28771
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES COc1ccc(CC(O)=O)cc1-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C27H22Cl2N2O6/c1-35-21-9-7-16(14-23(32)33)13-19(21)25-24(26(37-31-25)17-5-3-2-4-6-17)27(34)30-11-12-36-22-10-8-18(28)15-20(22)29/h2-10,13,15H,11-12,14H2,1H3,(H,30,34)(H,32,33)
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n/an/an/an/a 560n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM28772
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES CC(C)c1onc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1cccc(CC(O)=O)c1
Show InChI InChI=1S/C23H22Cl2N2O5/c1-13(2)22-20(21(27-32-22)15-5-3-4-14(10-15)11-19(28)29)23(30)26-8-9-31-18-7-6-16(24)12-17(18)25/h3-7,10,12-13H,8-9,11H2,1-2H3,(H,26,30)(H,28,29)
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n/an/an/an/a 1.07E+3n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM28773
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES OC(=O)Cc1cccc(c1)-c1noc(-c2ccco2)c1C(=O)NCCOc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C24H18Cl2N2O6/c25-16-6-7-18(17(26)13-16)33-10-8-27-24(31)21-22(28-34-23(21)19-5-2-9-32-19)15-4-1-3-14(11-15)12-20(29)30/h1-7,9,11,13H,8,10,12H2,(H,27,31)(H,29,30)
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n/an/an/an/a 90n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM28774
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES Cc1ccccc1-c1onc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1cccc(CC(O)=O)c1
Show InChI InChI=1S/C27H22Cl2N2O5/c1-16-5-2-3-8-20(16)26-24(25(31-36-26)18-7-4-6-17(13-18)14-23(32)33)27(34)30-11-12-35-22-10-9-19(28)15-21(22)29/h2-10,13,15H,11-12,14H2,1H3,(H,30,34)(H,32,33)
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n/an/an/an/a 50n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM28775
PNG
(2-{3-[5-(2-chlorophenyl)-4-{[2-(2,4-dichlorophenox...)
Show SMILES OC(=O)Cc1cccc(c1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1Cl
Show InChI InChI=1S/C26H19Cl3N2O5/c27-17-8-9-21(20(29)14-17)35-11-10-30-26(34)23-24(16-5-3-4-15(12-16)13-22(32)33)31-36-25(23)18-6-1-2-7-19(18)28/h1-9,12,14H,10-11,13H2,(H,30,34)(H,32,33)
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n/an/an/an/a 60n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM28764
PNG
(2-[3-chloro-4-(4-{[2-(2,4-dichlorophenoxy)ethyl]ca...)
Show SMILES OC(=O)Cc1ccc(-c2noc(c2C(=O)NCCOc2ccc(Cl)cc2Cl)-c2ccccc2)c(Cl)c1
Show InChI InChI=1S/C26H19Cl3N2O5/c27-17-7-9-21(20(29)14-17)35-11-10-30-26(34)23-24(31-36-25(23)16-4-2-1-3-5-16)18-8-6-15(12-19(18)28)13-22(32)33/h1-9,12,14H,10-11,13H2,(H,30,34)(H,32,33)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM28765
PNG
(2-{3-chloro-4-[(4-{[2-(2,4-dichlorophenoxy)ethyl]c...)
Show SMILES OC(=O)Cc1ccc(OCc2noc(c2C(=O)NCCOc2ccc(Cl)cc2Cl)-c2ccccc2)c(Cl)c1
Show InChI InChI=1S/C27H21Cl3N2O6/c28-18-7-9-22(20(30)14-18)36-11-10-31-27(35)25-21(32-38-26(25)17-4-2-1-3-5-17)15-37-23-8-6-16(12-19(23)29)13-24(33)34/h1-9,12,14H,10-11,13,15H2,(H,31,35)(H,33,34)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM28766
PNG
(2-[4-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES OC(=O)Cc1ccc(cc1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C26H20Cl2N2O5/c27-19-10-11-21(20(28)15-19)34-13-12-29-26(33)23-24(17-8-6-16(7-9-17)14-22(31)32)30-35-25(23)18-4-2-1-3-5-18/h1-11,15H,12-14H2,(H,29,33)(H,31,32)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM28767
PNG
(4-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-5-p...)
Show SMILES OC(=O)c1ccc(cc1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C25H18Cl2N2O5/c26-18-10-11-20(19(27)14-18)33-13-12-28-24(30)21-22(15-6-8-17(9-7-15)25(31)32)29-34-23(21)16-4-2-1-3-5-16/h1-11,14H,12-13H2,(H,28,30)(H,31,32)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM28768
PNG
(2-[4-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES Cc1cc(ccc1OCC(O)=O)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C27H22Cl2N2O6/c1-16-13-18(7-9-21(16)36-15-23(32)33)25-24(26(37-31-25)17-5-3-2-4-6-17)27(34)30-11-12-35-22-10-8-19(28)14-20(22)29/h2-10,13-14H,11-12,15H2,1H3,(H,30,34)(H,32,33)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM28769
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES OC(=O)Cc1cccc(c1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C26H20Cl2N2O5/c27-19-9-10-21(20(28)15-19)34-12-11-29-26(33)23-24(18-8-4-5-16(13-18)14-22(31)32)30-35-25(23)17-6-2-1-3-7-17/h1-10,13,15H,11-12,14H2,(H,29,33)(H,31,32)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM28770
PNG
(3-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES OC(=O)CCc1cccc(c1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C27H22Cl2N2O5/c28-20-10-11-22(21(29)16-20)35-14-13-30-27(34)24-25(31-36-26(24)18-6-2-1-3-7-18)19-8-4-5-17(15-19)9-12-23(32)33/h1-8,10-11,15-16H,9,12-14H2,(H,30,34)(H,32,33)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM28771
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES COc1ccc(CC(O)=O)cc1-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C27H22Cl2N2O6/c1-35-21-9-7-16(14-23(32)33)13-19(21)25-24(26(37-31-25)17-5-3-2-4-6-17)27(34)30-11-12-36-22-10-8-18(28)15-20(22)29/h2-10,13,15H,11-12,14H2,1H3,(H,30,34)(H,32,33)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM28772
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES CC(C)c1onc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1cccc(CC(O)=O)c1
Show InChI InChI=1S/C23H22Cl2N2O5/c1-13(2)22-20(21(27-32-22)15-5-3-4-14(10-15)11-19(28)29)23(30)26-8-9-31-18-7-6-16(24)12-17(18)25/h3-7,10,12-13H,8-9,11H2,1-2H3,(H,26,30)(H,28,29)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM28773
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES OC(=O)Cc1cccc(c1)-c1noc(-c2ccco2)c1C(=O)NCCOc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C24H18Cl2N2O6/c25-16-6-7-18(17(26)13-16)33-10-8-27-24(31)21-22(28-34-23(21)19-5-2-9-32-19)15-4-1-3-14(11-15)12-20(29)30/h1-7,9,11,13H,8,10,12H2,(H,27,31)(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM28774
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES Cc1ccccc1-c1onc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1cccc(CC(O)=O)c1
Show InChI InChI=1S/C27H22Cl2N2O5/c1-16-5-2-3-8-20(16)26-24(25(31-36-26)18-7-4-6-17(13-18)14-23(32)33)27(34)30-11-12-35-22-10-9-19(28)15-21(22)29/h2-10,13,15H,11-12,14H2,1H3,(H,30,34)(H,32,33)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha (PPAR alpha)


(Homo sapiens (Human))
BDBM28775
PNG
(2-{3-[5-(2-chlorophenyl)-4-{[2-(2,4-dichlorophenox...)
Show SMILES OC(=O)Cc1cccc(c1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1Cl
Show InChI InChI=1S/C26H19Cl3N2O5/c27-17-8-9-21(20(29)14-17)35-11-10-30-26(34)23-24(16-5-3-4-15(12-16)13-22(32)33)31-36-25(23)18-6-1-2-7-19(18)28/h1-9,12,14H,10-11,13H2,(H,30,34)(H,32,33)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM28764
PNG
(2-[3-chloro-4-(4-{[2-(2,4-dichlorophenoxy)ethyl]ca...)
Show SMILES OC(=O)Cc1ccc(-c2noc(c2C(=O)NCCOc2ccc(Cl)cc2Cl)-c2ccccc2)c(Cl)c1
Show InChI InChI=1S/C26H19Cl3N2O5/c27-17-7-9-21(20(29)14-17)35-11-10-30-26(34)23-24(31-36-25(23)16-4-2-1-3-5-16)18-8-6-15(12-19(18)28)13-22(32)33/h1-9,12,14H,10-11,13H2,(H,30,34)(H,32,33)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM28765
PNG
(2-{3-chloro-4-[(4-{[2-(2,4-dichlorophenoxy)ethyl]c...)
Show SMILES OC(=O)Cc1ccc(OCc2noc(c2C(=O)NCCOc2ccc(Cl)cc2Cl)-c2ccccc2)c(Cl)c1
Show InChI InChI=1S/C27H21Cl3N2O6/c28-18-7-9-22(20(30)14-18)36-11-10-31-27(35)25-21(32-38-26(25)17-4-2-1-3-5-17)15-37-23-8-6-16(12-19(23)29)13-24(33)34/h1-9,12,14H,10-11,13,15H2,(H,31,35)(H,33,34)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM28766
PNG
(2-[4-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES OC(=O)Cc1ccc(cc1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C26H20Cl2N2O5/c27-19-10-11-21(20(28)15-19)34-13-12-29-26(33)23-24(17-8-6-16(7-9-17)14-22(31)32)30-35-25(23)18-4-2-1-3-5-18/h1-11,15H,12-14H2,(H,29,33)(H,31,32)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM28767
PNG
(4-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-5-p...)
Show SMILES OC(=O)c1ccc(cc1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C25H18Cl2N2O5/c26-18-10-11-20(19(27)14-18)33-13-12-28-24(30)21-22(15-6-8-17(9-7-15)25(31)32)29-34-23(21)16-4-2-1-3-5-16/h1-11,14H,12-13H2,(H,28,30)(H,31,32)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM28768
PNG
(2-[4-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES Cc1cc(ccc1OCC(O)=O)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C27H22Cl2N2O6/c1-16-13-18(7-9-21(16)36-15-23(32)33)25-24(26(37-31-25)17-5-3-2-4-6-17)27(34)30-11-12-35-22-10-8-19(28)14-20(22)29/h2-10,13-14H,11-12,15H2,1H3,(H,30,34)(H,32,33)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM28769
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES OC(=O)Cc1cccc(c1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C26H20Cl2N2O5/c27-19-9-10-21(20(28)15-19)34-12-11-29-26(33)23-24(18-8-4-5-16(13-18)14-22(31)32)30-35-25(23)17-6-2-1-3-7-17/h1-10,13,15H,11-12,14H2,(H,29,33)(H,31,32)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM28770
PNG
(3-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES OC(=O)CCc1cccc(c1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C27H22Cl2N2O5/c28-20-10-11-22(21(29)16-20)35-14-13-30-27(34)24-25(31-36-26(24)18-6-2-1-3-7-18)19-8-4-5-17(15-19)9-12-23(32)33/h1-8,10-11,15-16H,9,12-14H2,(H,30,34)(H,32,33)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM28771
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES COc1ccc(CC(O)=O)cc1-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1
Show InChI InChI=1S/C27H22Cl2N2O6/c1-35-21-9-7-16(14-23(32)33)13-19(21)25-24(26(37-31-25)17-5-3-2-4-6-17)27(34)30-11-12-36-22-10-8-18(28)15-20(22)29/h2-10,13,15H,11-12,14H2,1H3,(H,30,34)(H,32,33)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM28772
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES CC(C)c1onc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1cccc(CC(O)=O)c1
Show InChI InChI=1S/C23H22Cl2N2O5/c1-13(2)22-20(21(27-32-22)15-5-3-4-14(10-15)11-19(28)29)23(30)26-8-9-31-18-7-6-16(24)12-17(18)25/h3-7,10,12-13H,8-9,11H2,1-2H3,(H,26,30)(H,28,29)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM28773
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES OC(=O)Cc1cccc(c1)-c1noc(-c2ccco2)c1C(=O)NCCOc1ccc(Cl)cc1Cl
Show InChI InChI=1S/C24H18Cl2N2O6/c25-16-6-7-18(17(26)13-16)33-10-8-27-24(31)21-22(28-34-23(21)19-5-2-9-32-19)15-4-1-3-14(11-15)12-20(29)30/h1-7,9,11,13H,8,10,12H2,(H,27,31)(H,29,30)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM28774
PNG
(2-[3-(4-{[2-(2,4-dichlorophenoxy)ethyl]carbamoyl}-...)
Show SMILES Cc1ccccc1-c1onc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1cccc(CC(O)=O)c1
Show InChI InChI=1S/C27H22Cl2N2O5/c1-16-5-2-3-8-20(16)26-24(25(31-36-26)18-7-4-6-17(13-18)14-23(32)33)27(34)30-11-12-35-22-10-9-19(28)15-21(22)29/h2-10,13,15H,11-12,14H2,1H3,(H,30,34)(H,32,33)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor


(Homo sapiens (Human))
BDBM28775
PNG
(2-{3-[5-(2-chlorophenyl)-4-{[2-(2,4-dichlorophenox...)
Show SMILES OC(=O)Cc1cccc(c1)-c1noc(c1C(=O)NCCOc1ccc(Cl)cc1Cl)-c1ccccc1Cl
Show InChI InChI=1S/C26H19Cl3N2O5/c27-17-8-9-21(20(29)14-17)35-11-10-30-26(34)23-24(16-5-3-4-15(12-16)13-22(32)33)31-36-25(23)18-6-1-2-7-19(18)28/h1-9,12,14H,10-11,13H2,(H,30,34)(H,32,33)
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n/an/an/an/a>1.00E+4n/an/an/an/a



GNF



Assay Description
EC50 is the concentration of test compounds needed to induce 50% of the maximum luciferase activity in HEK cells transfected with PPAR and Gal4-lucif...


Bioorg Med Chem Lett 16: 5488-92 (2006)


Article DOI: 10.1016/j.bmcl.2006.08.052
BindingDB Entry DOI: 10.7270/Q23X84Z3
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50244791
PNG
((2-Fluoro-4-methanesulfonyl-phenyl)-{6-[4-(3-isopr...)
Show SMILES CC(C)c1nc([o+][n-]1)C1CCN(CC1)c1ncnc(Nc2ccc(cc2F)S(C)(=O)=O)c1[N+]([O-])=O
Show InChI InChI=1S/C21H24FN7O5S/c1-12(2)18-26-21(34-27-18)13-6-8-28(9-7-13)20-17(29(30)31)19(23-11-24-20)25-16-5-4-14(10-15(16)22)35(3,32)33/h4-5,10-13H,6-9H2,1-3H3,(H,23,24,25)
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n/an/an/an/a 3.00E+3n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 overexpressed in CHO cells assessed as stimulation of cAMP production by HTRF assay


Bioorg Med Chem Lett 24: 2383-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.023
BindingDB Entry DOI: 10.7270/Q2KP83P1
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50013909
PNG
(CHEMBL3260505)
Show SMILES CCc1cnc(nc1)N1CCC(CC1)c1nc(COc2ccc(cc2)-n2cnnn2)cs1
Show InChI InChI=1S/C22H24N8OS/c1-2-16-11-23-22(24-12-16)29-9-7-17(8-10-29)21-26-18(14-32-21)13-31-20-5-3-19(4-6-20)30-15-25-27-28-30/h3-6,11-12,14-15,17H,2,7-10,13H2,1H3
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n/an/an/an/a 5.00E+3n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 overexpressed in CHO cells assessed as stimulation of cAMP production by HTRF assay


Bioorg Med Chem Lett 24: 2383-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.023
BindingDB Entry DOI: 10.7270/Q2KP83P1
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50013910
PNG
(CHEMBL3260504)
Show SMILES CC(C)c1noc(n1)N1CCC(COc2ccc(cc2)-c2ccc(nc2)S(C)(=O)=O)CC1
Show InChI InChI=1S/C23H28N4O4S/c1-16(2)22-25-23(31-26-22)27-12-10-17(11-13-27)15-30-20-7-4-18(5-8-20)19-6-9-21(24-14-19)32(3,28)29/h4-9,14,16-17H,10-13,15H2,1-3H3
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n/an/an/an/a 9.00E+3n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 overexpressed in CHO cells assessed as stimulation of cAMP production by HTRF assay


Bioorg Med Chem Lett 24: 2383-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.023
BindingDB Entry DOI: 10.7270/Q2KP83P1
More data for this
Ligand-Target Pair
Glucose-dependent insulinotropic receptor


(Mus musculus)
BDBM50013911
PNG
(CHEMBL3260533)
Show SMILES CCOC(=O)[C@](C)(Cc1ccccc1)c1ccnc2c(cnn12)-c1ccc(cc1)C(F)(F)F |r|
Show InChI InChI=1S/C25H22F3N3O2/c1-3-33-23(32)24(2,15-17-7-5-4-6-8-17)21-13-14-29-22-20(16-30-31(21)22)18-9-11-19(12-10-18)25(26,27)28/h4-14,16H,3,15H2,1-2H3/t24-/m1/s1
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n/an/an/an/a 19n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR119 overexpressed in CHO cells assessed as stimulation of cAMP production by HTRF assay


Bioorg Med Chem Lett 24: 2383-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.023
BindingDB Entry DOI: 10.7270/Q2KP83P1
More data for this
Ligand-Target Pair
Glucose-dependent insulinotropic receptor


(Mus musculus)
BDBM50013912
PNG
(CHEMBL3260536)
Show SMILES COCCN(C)C(=O)C(C)(Cc1ccccc1)c1ccnc2c(cnn12)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C27H27F3N4O2/c1-26(17-19-7-5-4-6-8-19,25(35)33(2)15-16-36-3)23-13-14-31-24-22(18-32-34(23)24)20-9-11-21(12-10-20)27(28,29)30/h4-14,18H,15-17H2,1-3H3
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n/an/an/an/a 30n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at GPR119 in mouse GLUTag cells assessed as stimulation of GLP1 secretion by CRE-luciferase reporter gene assay


Bioorg Med Chem Lett 24: 2383-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.023
BindingDB Entry DOI: 10.7270/Q2KP83P1
More data for this
Ligand-Target Pair
Glucose-dependent insulinotropic receptor


(Mus musculus)
BDBM50013913
PNG
(CHEMBL3260540)
Show SMILES CCOC(=O)[C@](C)(Cc1ccccc1)c1cnnc2c(cnn12)-c1ccc(cc1)C(F)(F)F |r|
Show InChI InChI=1S/C24H21F3N4O2/c1-3-33-22(32)23(2,13-16-7-5-4-6-8-16)20-15-28-30-21-19(14-29-31(20)21)17-9-11-18(12-10-17)24(25,26)27/h4-12,14-15H,3,13H2,1-2H3/t23-/m1/s1
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n/an/an/an/a 39n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR119 overexpressed in CHO cells assessed as stimulation of cAMP production by HTRF assay


Bioorg Med Chem Lett 24: 2383-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.023
BindingDB Entry DOI: 10.7270/Q2KP83P1
More data for this
Ligand-Target Pair
Glucose-dependent insulinotropic receptor


(Mus musculus)
BDBM50013912
PNG
(CHEMBL3260536)
Show SMILES COCCN(C)C(=O)C(C)(Cc1ccccc1)c1ccnc2c(cnn12)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C27H27F3N4O2/c1-26(17-19-7-5-4-6-8-19,25(35)33(2)15-16-36-3)23-13-14-31-24-22(18-32-34(23)24)20-9-11-21(12-10-20)27(28,29)30/h4-14,18H,15-17H2,1-3H3
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n/an/an/an/a 49n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR119 overexpressed in CHO cells assessed as stimulation of cAMP production by HTRF assay


Bioorg Med Chem Lett 24: 2383-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.023
BindingDB Entry DOI: 10.7270/Q2KP83P1
More data for this
Ligand-Target Pair
Glucose-dependent insulinotropic receptor


(Mus musculus)
BDBM50013914
PNG
(CHEMBL3260518)
Show SMILES CCOC(=O)[C@](C)(Cc1ccccc1)c1ccnc2c(cnn12)-c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C24H22ClN3O2/c1-3-30-23(29)24(2,15-17-7-5-4-6-8-17)21-13-14-26-22-20(16-27-28(21)22)18-9-11-19(25)12-10-18/h4-14,16H,3,15H2,1-2H3/t24-/m1/s1
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n/an/an/an/a 76n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at mouse GPR119 overexpressed in CHO cells assessed as stimulation of cAMP production by HTRF assay


Bioorg Med Chem Lett 24: 2383-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.023
BindingDB Entry DOI: 10.7270/Q2KP83P1
More data for this
Ligand-Target Pair
Glucose-dependent insulinotropic receptor


(Mus musculus)
BDBM50013913
PNG
(CHEMBL3260540)
Show SMILES CCOC(=O)[C@](C)(Cc1ccccc1)c1cnnc2c(cnn12)-c1ccc(cc1)C(F)(F)F |r|
Show InChI InChI=1S/C24H21F3N4O2/c1-3-33-22(32)23(2,13-16-7-5-4-6-8-16)20-15-28-30-21-19(14-29-31(20)21)17-9-11-18(12-10-17)24(25,26)27/h4-12,14-15H,3,13H2,1-2H3/t23-/m1/s1
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n/an/an/an/a 230n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at GPR119 in mouse GLUTag cells assessed as stimulation of GLP1 secretion by CRE-luciferase reporter gene assay


Bioorg Med Chem Lett 24: 2383-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.023
BindingDB Entry DOI: 10.7270/Q2KP83P1
More data for this
Ligand-Target Pair
Glucose-dependent insulinotropic receptor


(Mus musculus)
BDBM50013911
PNG
(CHEMBL3260533)
Show SMILES CCOC(=O)[C@](C)(Cc1ccccc1)c1ccnc2c(cnn12)-c1ccc(cc1)C(F)(F)F |r|
Show InChI InChI=1S/C25H22F3N3O2/c1-3-33-23(32)24(2,15-17-7-5-4-6-8-17)21-13-14-29-22-20(16-30-31(21)22)18-9-11-19(12-10-18)25(26,27)28/h4-14,16H,3,15H2,1-2H3/t24-/m1/s1
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n/an/an/an/a 330n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at GPR119 in mouse GLUTag cells assessed as stimulation of GLP1 secretion by CRE-luciferase reporter gene assay


Bioorg Med Chem Lett 24: 2383-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.023
BindingDB Entry DOI: 10.7270/Q2KP83P1
More data for this
Ligand-Target Pair
Glucose-dependent insulinotropic receptor


(Mus musculus)
BDBM50013914
PNG
(CHEMBL3260518)
Show SMILES CCOC(=O)[C@](C)(Cc1ccccc1)c1ccnc2c(cnn12)-c1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C24H22ClN3O2/c1-3-30-23(29)24(2,15-17-7-5-4-6-8-17)21-13-14-26-22-20(16-27-28(21)22)18-9-11-19(25)12-10-18/h4-14,16H,3,15H2,1-2H3/t24-/m1/s1
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n/an/an/an/a 510n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at GPR119 in mouse GLUTag cells assessed as stimulation of GLP1 secretion by CRE-luciferase reporter gene assay


Bioorg Med Chem Lett 24: 2383-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.023
BindingDB Entry DOI: 10.7270/Q2KP83P1
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50013915
PNG
(CHEMBL1081913)
Show SMILES CC(C)(C)OC(=O)N1CCC(CC1)OCc1nc(no1)-c1ccncc1
Show InChI InChI=1S/C18H24N4O4/c1-18(2,3)25-17(23)22-10-6-14(7-11-22)24-12-15-20-16(21-26-15)13-4-8-19-9-5-13/h4-5,8-9,14H,6-7,10-12H2,1-3H3
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n/an/an/an/a 6.30E+5n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 overexpressed in CHO cells assessed as stimulation of cAMP production by HTRF assay


Bioorg Med Chem Lett 24: 2383-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.023
BindingDB Entry DOI: 10.7270/Q2KP83P1
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50013912
PNG
(CHEMBL3260536)
Show SMILES COCCN(C)C(=O)C(C)(Cc1ccccc1)c1ccnc2c(cnn12)-c1ccc(cc1)C(F)(F)F
Show InChI InChI=1S/C27H27F3N4O2/c1-26(17-19-7-5-4-6-8-19,25(35)33(2)15-16-36-3)23-13-14-31-24-22(18-32-34(23)24)20-9-11-21(12-10-20)27(28,29)30/h4-14,18H,15-17H2,1-3H3
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n/an/an/an/a 1n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 overexpressed in CHO cells assessed as stimulation of cAMP production by HTRF assay


Bioorg Med Chem Lett 24: 2383-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.023
BindingDB Entry DOI: 10.7270/Q2KP83P1
More data for this
Ligand-Target Pair
G-protein coupled receptor 119 (GPR119)


(Homo sapiens (Human))
BDBM50013916
PNG
(CHEMBL3260535)
Show SMILES COCCOC(=O)C(C)(Cc1ccccc1)c1ccnc2c(cnn12)-c1ccc(Cl)cc1
Show InChI InChI=1S/C25H24ClN3O3/c1-25(24(30)32-15-14-31-2,16-18-6-4-3-5-7-18)22-12-13-27-23-21(17-28-29(22)23)19-8-10-20(26)11-9-19/h3-13,17H,14-16H2,1-2H3
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n/an/an/an/a 4n/an/an/an/a



Genomics Institute of the Novartis Research Foundation

Curated by ChEMBL


Assay Description
Agonist activity at human GPR119 overexpressed in CHO cells assessed as stimulation of cAMP production by HTRF assay


Bioorg Med Chem Lett 24: 2383-7 (2014)


Article DOI: 10.1016/j.bmcl.2014.03.023
BindingDB Entry DOI: 10.7270/Q2KP83P1
More data for this
Ligand-Target Pair
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