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PubMed code 26234904

Compile data set for download or QSAR
Found 57 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
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50085570
PNG
(CHEMBL3427710)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2CCc3c2cccc3OCC)cc1 |r|
Show InChI InChI=1S/C22H26O5/c1-3-25-19-7-5-6-17-18(19)12-13-20(17)27-16-10-8-15(9-11-16)21(26-4-2)14-22(23)24/h5-11,20-21H,3-4,12-14H2,1-2H3,(H,23,24)/t20-,21+/m1/s1
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n/an/an/an/a 63n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114354
PNG
(CHEMBL3604045)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2cccc(c2)C#N)cc1
Show InChI InChI=1S/C19H19NO4/c1-2-23-18(11-19(21)22)16-6-8-17(9-7-16)24-13-15-5-3-4-14(10-15)12-20/h3-10,18H,2,11,13H2,1H3,(H,21,22)
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n/an/an/an/a 53n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114107
PNG
(CHEMBL3604060)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(Oc2noc3c(C)cccc23)cc1 |r|
Show InChI InChI=1S/C19H19NO5/c1-3-23-16(11-17(21)22)13-7-9-14(10-8-13)24-19-15-6-4-5-12(2)18(15)25-20-19/h4-10,16H,3,11H2,1-2H3,(H,21,22)/t16-/m0/s1
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n/an/an/an/a 120n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114210
PNG
(CHEMBL3604039)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1OC
Show InChI InChI=1S/C19H20Cl2O5/c1-3-25-18(10-19(22)23)14-6-5-13(9-17(14)24-2)26-11-12-4-7-15(20)16(21)8-12/h4-9,18H,3,10-11H2,1-2H3,(H,22,23)
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n/an/an/an/a 970n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114267
PNG
(CHEMBL3604035)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)c(C)c1
Show InChI InChI=1S/C19H20Cl2O4/c1-3-24-18(10-19(22)23)14-5-7-17(12(2)8-14)25-11-13-4-6-15(20)16(21)9-13/h4-9,18H,3,10-11H2,1-2H3,(H,22,23)
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n/an/an/an/a 1.50E+3n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114268
PNG
(CHEMBL3604034)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)c(F)c1
Show InChI InChI=1S/C18H17Cl2FO4/c1-2-24-17(9-18(22)23)12-4-6-16(15(21)8-12)25-10-11-3-5-13(19)14(20)7-11/h3-8,17H,2,9-10H2,1H3,(H,22,23)
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n/an/an/an/a 210n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114108
PNG
(CHEMBL3604059)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(OC2CCc3ncccc23)cc1 |r|
Show InChI InChI=1S/C19H21NO4/c1-2-23-18(12-19(21)22)13-5-7-14(8-6-13)24-17-10-9-16-15(17)4-3-11-20-16/h3-8,11,17-18H,2,9-10,12H2,1H3,(H,21,22)/t17?,18-/m0/s1
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n/an/an/an/a 5.60E+3n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114110
PNG
(CHEMBL3604043)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2cccc(OCOC)c2)cc1
Show InChI InChI=1S/C20H24O6/c1-3-24-19(12-20(21)22)16-7-9-17(10-8-16)25-13-15-5-4-6-18(11-15)26-14-23-2/h4-11,19H,3,12-14H2,1-2H3,(H,21,22)
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n/an/an/an/a 100n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114269
PNG
(CHEMBL3604033)
Show SMILES CCOC(CC(O)=O)c1ccc(NCc2ccc(Cl)c(Cl)c2)cc1
Show InChI InChI=1S/C18H19Cl2NO3/c1-2-24-17(10-18(22)23)13-4-6-14(7-5-13)21-11-12-3-8-15(19)16(20)9-12/h3-9,17,21H,2,10-11H2,1H3,(H,22,23)
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n/an/an/an/a 27n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114272
PNG
(CHEMBL3604030)
Show SMILES CCOC(c1ccc(OCc2ccccc2C)cc1)C(F)(F)C(O)=O
Show InChI InChI=1S/C19H20F2O4/c1-3-24-17(19(20,21)18(22)23)14-8-10-16(11-9-14)25-12-15-7-5-4-6-13(15)2/h4-11,17H,3,12H2,1-2H3,(H,22,23)
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n/an/an/an/a 3.80E+3n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50085572
PNG
(CHEMBL3427708)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2CCCc3ccccc23)cc1 |r|
Show InChI InChI=1S/C21H24O4/c1-2-24-20(14-21(22)23)16-10-12-17(13-11-16)25-19-9-5-7-15-6-3-4-8-18(15)19/h3-4,6,8,10-13,19-20H,2,5,7,9,14H2,1H3,(H,22,23)/t19-,20+/m1/s1
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n/an/an/an/a 62n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50085593
PNG
(CHEMBL3427703)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1 |r|
Show InChI InChI=1S/C18H18Cl2O4/c1-2-23-17(10-18(21)22)13-4-6-14(7-5-13)24-11-12-3-8-15(19)16(20)9-12/h3-9,17H,2,10-11H2,1H3,(H,21,22)/t17-/m0/s1
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n/an/an/an/a 3.90n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114091
PNG
(CHEMBL3604066)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2COc3c2cccc3C(F)(F)F)cc1 |r|
Show InChI InChI=1S/C20H19F3O5/c1-2-26-16(10-18(24)25)12-6-8-13(9-7-12)28-17-11-27-19-14(17)4-3-5-15(19)20(21,22)23/h3-9,16-17H,2,10-11H2,1H3,(H,24,25)/t16-,17+/m0/s1
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n/an/an/an/a 21n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114106
PNG
(CHEMBL3604061)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2CCc3c2cccc3CC)cc1 |r|
Show InChI InChI=1S/C22H26O4/c1-3-15-6-5-7-19-18(15)12-13-20(19)26-17-10-8-16(9-11-17)21(25-4-2)14-22(23)24/h5-11,20-21H,3-4,12-14H2,1-2H3,(H,23,24)/t20-,21+/m1/s1
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n/an/an/an/a 12n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114190
PNG
(CHEMBL3604042)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2cccc(OC)c2)cc1
Show InChI InChI=1S/C19H22O5/c1-3-23-18(12-19(20)21)15-7-9-16(10-8-15)24-13-14-5-4-6-17(11-14)22-2/h4-11,18H,3,12-13H2,1-2H3,(H,20,21)
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n/an/an/an/a 89n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114264
PNG
(CHEMBL3604038)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1Cl
Show InChI InChI=1S/C18H17Cl3O4/c1-2-24-17(9-18(22)23)13-5-4-12(8-15(13)20)25-10-11-3-6-14(19)16(21)7-11/h3-8,17H,2,9-10H2,1H3,(H,22,23)
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n/an/an/an/a 98n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114104
PNG
(CHEMBL3604063)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2CCc3c2cccc3C2CC2)cc1 |r|
Show InChI InChI=1S/C23H26O4/c1-2-26-22(14-23(24)25)16-8-10-17(11-9-16)27-21-13-12-19-18(15-6-7-15)4-3-5-20(19)21/h3-5,8-11,15,21-22H,2,6-7,12-14H2,1H3,(H,24,25)/t21-,22+/m1/s1
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n/an/an/an/a 13n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114204
PNG
(CHEMBL3604040)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2cccc(F)c2)cc1
Show InChI InChI=1S/C18H19FO4/c1-2-22-17(11-18(20)21)14-6-8-16(9-7-14)23-12-13-4-3-5-15(19)10-13/h3-10,17H,2,11-12H2,1H3,(H,20,21)
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n/an/an/an/a 30n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114265
PNG
(CHEMBL3604037)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1F
Show InChI InChI=1S/C18H17Cl2FO4/c1-2-24-17(9-18(22)23)13-5-4-12(8-16(13)21)25-10-11-3-6-14(19)15(20)7-11/h3-8,17H,2,9-10H2,1H3,(H,22,23)
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n/an/an/an/a 12n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114270
PNG
(CHEMBL3604032)
Show SMILES CCOC(CC(O)=O)c1ccc(NC(=O)c2ccccc2C)cc1
Show InChI InChI=1S/C19H21NO4/c1-3-24-17(12-18(21)22)14-8-10-15(11-9-14)20-19(23)16-7-5-4-6-13(16)2/h4-11,17H,3,12H2,1-2H3,(H,20,23)(H,21,22)
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n/an/an/an/a 1.60E+3n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114273
PNG
(CHEMBL3604029)
Show SMILES CCOC(Cc1nnn[nH]1)c1ccc(OCc2ccccc2C)cc1
Show InChI InChI=1S/C19H22N4O2/c1-3-24-18(12-19-20-22-23-21-19)15-8-10-17(11-9-15)25-13-16-7-5-4-6-14(16)2/h4-11,18H,3,12-13H2,1-2H3,(H,20,21,22,23)
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n/an/an/an/a 1.70E+3n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114345
PNG
(CHEMBL3604054)
Show SMILES CCOC(CC(O)=O)c1ccc(Oc2ccc(Cl)c(Cl)c2)cc1
Show InChI InChI=1S/C17H16Cl2O4/c1-2-22-16(10-17(20)21)11-3-5-12(6-4-11)23-13-7-8-14(18)15(19)9-13/h3-9,16H,2,10H2,1H3,(H,20,21)
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n/an/an/an/a 49n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114351
PNG
(CHEMBL3604048)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C19H19F3O4/c1-2-25-17(11-18(23)24)14-5-9-16(10-6-14)26-12-13-3-7-15(8-4-13)19(20,21)22/h3-10,17H,2,11-12H2,1H3,(H,23,24)
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n/an/an/an/a 7.20n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114353
PNG
(CHEMBL3604046)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2cccc(c2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C18H19NO6/c1-2-24-17(11-18(20)21)14-6-8-16(9-7-14)25-12-13-4-3-5-15(10-13)19(22)23/h3-10,17H,2,11-12H2,1H3,(H,20,21)
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n/an/an/an/a 63n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114089
PNG
(CHEMBL3604068)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2COc3c2cccc3C(F)(F)F)nc1 |r|
Show InChI InChI=1S/C19H18F3NO5/c1-2-26-14(8-17(24)25)11-6-7-16(23-9-11)28-15-10-27-18-12(15)4-3-5-13(18)19(20,21)22/h3-7,9,14-15H,2,8,10H2,1H3,(H,24,25)/t14-,15+/m0/s1
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n/an/an/an/a 36n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50085568
PNG
(CHEMBL3427712)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2CCc3c2cccc3C(F)(F)F)cc1 |r|
Show InChI InChI=1S/C21H21F3O4/c1-2-27-19(12-20(25)26)13-6-8-14(9-7-13)28-18-11-10-15-16(18)4-3-5-17(15)21(22,23)24/h3-9,18-19H,2,10-12H2,1H3,(H,25,26)/t18-,19+/m1/s1
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n/an/an/an/a 3.70n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50019111
PNG
(CHEMBL3288363)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2cccc(C)c2)cc1
Show InChI InChI=1S/C19H22O4/c1-3-22-18(12-19(20)21)16-7-9-17(10-8-16)23-13-15-6-4-5-14(2)11-15/h4-11,18H,3,12-13H2,1-2H3,(H,20,21)
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n/an/an/an/a 35n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114266
PNG
(CHEMBL3604036)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)c(c1)[N+]([O-])=O
Show InChI InChI=1S/C18H17Cl2NO6/c1-2-26-17(9-18(22)23)12-4-6-16(15(8-12)21(24)25)27-10-11-3-5-13(19)14(20)7-11/h3-8,17H,2,9-10H2,1H3,(H,22,23)
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n/an/an/an/a 3.10E+3n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50019110
PNG
(CHEMBL3288362)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2ccccc2C)cc1
Show InChI InChI=1S/C19H22O4/c1-3-22-18(12-19(20)21)15-8-10-17(11-9-15)23-13-16-7-5-4-6-14(16)2/h4-11,18H,3,12-13H2,1-2H3,(H,20,21)
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n/an/an/an/a 20n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50085573
PNG
(CHEMBL3427707)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(OC2Cc3ccccc3C2)cc1 |r|
Show InChI InChI=1S/C20H22O4/c1-2-23-19(13-20(21)22)14-7-9-17(10-8-14)24-18-11-15-5-3-4-6-16(15)12-18/h3-10,18-19H,2,11-13H2,1H3,(H,21,22)/t19-/m0/s1
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n/an/an/an/a 82n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50085574
PNG
(CHEMBL3427706)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@H]2CCc3ccccc23)cc1 |r|
Show InChI InChI=1S/C20H22O4/c1-2-23-19(13-20(21)22)15-7-10-16(11-8-15)24-18-12-9-14-5-3-4-6-17(14)18/h3-8,10-11,18-19H,2,9,12-13H2,1H3,(H,21,22)/t18-,19-/m0/s1
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n/an/an/an/a 69n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114275
PNG
(CHEMBL3604057)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(OCc2ccc(cc2F)C(F)(F)F)cc1 |r|
Show InChI InChI=1S/C19H18F4O4/c1-2-26-17(10-18(24)25)12-4-7-15(8-5-12)27-11-13-3-6-14(9-16(13)20)19(21,22)23/h3-9,17H,2,10-11H2,1H3,(H,24,25)/t17-/m0/s1
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n/an/an/an/a 13n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50085548
PNG
(CHEMBL3425533)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(OCc2ccc(cc2)C(F)(F)F)cc1 |r|
Show InChI InChI=1S/C19H19F3O4/c1-2-25-17(11-18(23)24)14-5-9-16(10-6-14)26-12-13-3-7-15(8-4-13)19(20,21)22/h3-10,17H,2,11-12H2,1H3,(H,23,24)/t17-/m0/s1
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n/an/an/an/a 5.30n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114344
PNG
(CHEMBL3604055)
Show SMILES CCOC(CC(O)=O)c1ccc(Oc2ccc(Cl)c3ccccc23)cc1
Show InChI InChI=1S/C21H19ClO4/c1-2-25-20(13-21(23)24)14-7-9-15(10-8-14)26-19-12-11-18(22)16-5-3-4-6-17(16)19/h3-12,20H,2,13H2,1H3,(H,23,24)
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n/an/an/an/a 560n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114346
PNG
(CHEMBL3604053)
Show SMILES CCOC(CC(O)=O)c1ccc(OCCc2ccc(Cl)c(Cl)c2)cc1
Show InChI InChI=1S/C19H20Cl2O4/c1-2-24-18(12-19(22)23)14-4-6-15(7-5-14)25-10-9-13-3-8-16(20)17(21)11-13/h3-8,11,18H,2,9-10,12H2,1H3,(H,22,23)
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n/an/an/an/a 65n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114350
PNG
(CHEMBL3604049)
Show SMILES CCOC(CC(O)=O)c1ccc(OCC2CCCCC2)cc1
Show InChI InChI=1S/C18H26O4/c1-2-21-17(12-18(19)20)15-8-10-16(11-9-15)22-13-14-6-4-3-5-7-14/h8-11,14,17H,2-7,12-13H2,1H3,(H,19,20)
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n/an/an/an/a 35n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114098
PNG
(CHEMBL3603843)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2CCc3cc(ccc23)C(F)(F)F)cc1 |r|
Show InChI InChI=1S/C21H21F3O4/c1-2-27-19(12-20(25)26)13-3-7-16(8-4-13)28-18-10-5-14-11-15(21(22,23)24)6-9-17(14)18/h3-4,6-9,11,18-19H,2,5,10,12H2,1H3,(H,25,26)/t18-,19+/m1/s1
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n/an/an/an/a 13n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114105
PNG
(CHEMBL3604062)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2CCc3c2cccc3C(C)C)cc1 |r|
Show InChI InChI=1S/C23H28O4/c1-4-26-22(14-23(24)25)16-8-10-17(11-9-16)27-21-13-12-19-18(15(2)3)6-5-7-20(19)21/h5-11,15,21-22H,4,12-14H2,1-3H3,(H,24,25)/t21-,22+/m1/s1
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n/an/an/an/a 12n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50019112
PNG
(CHEMBL3286417)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2ccc(C)cc2)cc1
Show InChI InChI=1S/C19H22O4/c1-3-22-18(12-19(20)21)16-8-10-17(11-9-16)23-13-15-6-4-14(2)5-7-15/h4-11,18H,3,12-13H2,1-2H3,(H,20,21)
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n/an/an/an/a 370n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114271
PNG
(CHEMBL3604031)
Show SMILES CCOC(CC(=O)NS(C)(=O)=O)c1ccc(OCc2ccccc2C)cc1
Show InChI InChI=1S/C20H25NO5S/c1-4-25-19(13-20(22)21-27(3,23)24)16-9-11-18(12-10-16)26-14-17-8-6-5-7-15(17)2/h5-12,19H,4,13-14H2,1-3H3,(H,21,22)
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n/an/an/an/a 580n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114347
PNG
(CHEMBL3604052)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2ccc(F)c3ccccc23)cc1
Show InChI InChI=1S/C22H21FO4/c1-2-26-21(13-22(24)25)15-7-10-17(11-8-15)27-14-16-9-12-20(23)19-6-4-3-5-18(16)19/h3-12,21H,2,13-14H2,1H3,(H,24,25)
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n/an/an/an/a 13n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50085594
PNG
(CHEMBL3427702)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1
Show InChI InChI=1S/C18H18Cl2O4/c1-2-23-17(10-18(21)22)13-4-6-14(7-5-13)24-11-12-3-8-15(19)16(20)9-12/h3-9,17H,2,10-11H2,1H3,(H,21,22)
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n/an/an/an/a 6.20n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114352
PNG
(CHEMBL3604047)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C18H19ClO4/c1-2-22-17(11-18(20)21)14-5-9-16(10-6-14)23-12-13-3-7-15(19)8-4-13/h3-10,17H,2,11-12H2,1H3,(H,20,21)
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n/an/an/an/a 12n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Rattus norvegicus)
BDBM50085568
PNG
(CHEMBL3427712)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2CCc3c2cccc3C(F)(F)F)cc1 |r|
Show InChI InChI=1S/C21H21F3O4/c1-2-27-19(12-20(25)26)13-6-8-14(9-7-13)28-18-11-10-15-16(18)4-3-5-17(15)21(22,23)24/h3-9,18-19H,2,10-12H2,1H3,(H,25,26)/t18-,19+/m1/s1
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n/an/an/an/a 11n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at rat GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114090
PNG
(CHEMBL3604067)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2CCc3c2cccc3C(F)(F)F)nc1 |r|
Show InChI InChI=1S/C20H20F3NO4/c1-2-27-17(10-19(25)26)12-6-9-18(24-11-12)28-16-8-7-13-14(16)4-3-5-15(13)20(21,22)23/h3-6,9,11,16-17H,2,7-8,10H2,1H3,(H,25,26)/t16-,17+/m1/s1
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n/an/an/an/a 20n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114102
PNG
(CHEMBL3604065)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2CCc3c2cccc3OC(F)(F)F)cc1 |r|
Show InChI InChI=1S/C21H21F3O5/c1-2-27-19(12-20(25)26)13-6-8-14(9-7-13)28-17-11-10-16-15(17)4-3-5-18(16)29-21(22,23)24/h3-9,17,19H,2,10-12H2,1H3,(H,25,26)/t17-,19+/m1/s1
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n/an/an/an/a 9.90n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50085569
PNG
(CHEMBL3427711)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2CCc3c2cccc3Cl)cc1 |r|
Show InChI InChI=1S/C20H21ClO4/c1-2-24-19(12-20(22)23)13-6-8-14(9-7-13)25-18-11-10-15-16(18)4-3-5-17(15)21/h3-9,18-19H,2,10-12H2,1H3,(H,22,23)/t18-,19+/m1/s1
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n/an/an/an/a 5n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50085571
PNG
(CHEMBL3427709)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2CCc3c2cccc3C)cc1 |r|
Show InChI InChI=1S/C21H24O4/c1-3-24-20(13-21(22)23)15-7-9-16(10-8-15)25-19-12-11-17-14(2)5-4-6-18(17)19/h4-10,19-20H,3,11-13H2,1-2H3,(H,22,23)/t19-,20+/m1/s1
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n/an/an/an/a 29n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114203
PNG
(CHEMBL3604041)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2cccc(Cl)c2)cc1
Show InChI InChI=1S/C18H19ClO4/c1-2-22-17(11-18(20)21)14-6-8-16(9-7-14)23-12-13-4-3-5-15(19)10-13/h3-10,17H,2,11-12H2,1H3,(H,20,21)
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n/an/an/an/a 19n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50085592
PNG
(CHEMBL3427704)
Show SMILES CCO[C@H](CC(O)=O)c1ccc(OCc2ccc(Cl)c(Cl)c2)cc1 |r|
Show InChI InChI=1S/C18H18Cl2O4/c1-2-23-17(10-18(21)22)13-4-6-14(7-5-13)24-11-12-3-8-15(19)16(20)9-12/h3-9,17H,2,10-11H2,1H3,(H,21,22)/t17-/m1/s1
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n/an/an/an/a 360n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114343
PNG
(CHEMBL3604056)
Show SMILES CCOC(CC(O)=O)c1cccc(OCc2ccc(Cl)c(Cl)c2)c1
Show InChI InChI=1S/C18H18Cl2O4/c1-2-23-17(10-18(21)22)13-4-3-5-14(9-13)24-11-12-6-7-15(19)16(20)8-12/h3-9,17H,2,10-11H2,1H3,(H,21,22)
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n/an/an/an/a 147n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114109
PNG
(CHEMBL3604044)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2cccc(Oc3ccccc3)c2)cc1
Show InChI InChI=1S/C24H24O5/c1-2-27-23(16-24(25)26)19-11-13-20(14-12-19)28-17-18-7-6-10-22(15-18)29-21-8-4-3-5-9-21/h3-15,23H,2,16-17H2,1H3,(H,25,26)
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n/an/an/an/a 23n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50085591
PNG
(CHEMBL3427705)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(O[C@@H]2CCc3ccccc23)cc1 |r|
Show InChI InChI=1S/C20H22O4/c1-2-23-19(13-20(21)22)15-7-10-16(11-8-15)24-18-12-9-14-5-3-4-6-17(14)18/h3-8,10-11,18-19H,2,9,12-13H2,1H3,(H,21,22)/t18-,19+/m1/s1
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n/an/an/an/a 31n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114274
PNG
(CHEMBL3604058)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(OCc2ccc(c(F)c2)C(F)(F)F)cc1 |r|
Show InChI InChI=1S/C19H18F4O4/c1-2-26-17(10-18(24)25)13-4-6-14(7-5-13)27-11-12-3-8-15(16(20)9-12)19(21,22)23/h3-9,17H,2,10-11H2,1H3,(H,24,25)/t17-/m0/s1
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n/an/an/an/a 7.5n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114348
PNG
(CHEMBL3604051)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2cc(C)nn2C)cc1
Show InChI InChI=1S/C17H22N2O4/c1-4-22-16(10-17(20)21)13-5-7-15(8-6-13)23-11-14-9-12(2)18-19(14)3/h5-9,16H,4,10-11H2,1-3H3,(H,20,21)
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n/an/an/an/a 3.20E+3n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114349
PNG
(CHEMBL3604050)
Show SMILES CCOC(CC(O)=O)c1ccc(OCc2cccnc2C)cc1
Show InChI InChI=1S/C18H21NO4/c1-3-22-17(11-18(20)21)14-6-8-16(9-7-14)23-12-15-5-4-10-19-13(15)2/h4-10,17H,3,11-12H2,1-2H3,(H,20,21)
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n/an/an/an/a 2.10E+3n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50114103
PNG
(CHEMBL3604064)
Show SMILES CCO[C@@H](CC(O)=O)c1ccc(OC2CCc3c2cccc3OC)cc1 |r|
Show InChI InChI=1S/C21H24O5/c1-3-25-20(13-21(22)23)14-7-9-15(10-8-14)26-19-12-11-17-16(19)5-4-6-18(17)24-2/h4-10,19-20H,3,11-13H2,1-2H3,(H,22,23)/t19?,20-/m0/s1
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n/an/an/an/a 190n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells assessed as increase in intracellular calcium level after 60 mins by FLIPR assay


Bioorg Med Chem 23: 5546-65 (2015)


Article DOI: 10.1016/j.bmc.2015.07.028
BindingDB Entry DOI: 10.7270/Q2K0762X
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%