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Compile Data Set for Download or QSAR

Found 38 hits from Enamine Ltd   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM50107285
PNG
(CHEMBL3601060)
Show SMILES OC(=O)CCc1ccc(OCc2nc(no2)-c2ccco2)cc1
Show InChI InChI=1S/C16H14N2O5/c19-15(20)8-5-11-3-6-12(7-4-11)22-10-14-17-16(18-23-14)13-2-1-9-21-13/h1-4,6-7,9H,5,8,10H2,(H,19,20)
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n/an/an/an/a>1.00E+5n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50107303
PNG
(CHEMBL3601003)
Show SMILES OC(=O)CCc1ccc(OCc2nc(no2)-c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C18H15ClN2O4/c19-14-6-4-13(5-7-14)18-20-16(25-21-18)11-24-15-8-1-12(2-9-15)3-10-17(22)23/h1-2,4-9H,3,10-11H2,(H,22,23)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR120 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107287
PNG
(CHEMBL3601058)
Show SMILES OC(=O)CCc1ccc(OCc2nc(no2)-c2ccccc2)c(Cl)c1
Show InChI InChI=1S/C18H15ClN2O4/c19-14-10-12(7-9-17(22)23)6-8-15(14)24-11-16-20-18(21-25-16)13-4-2-1-3-5-13/h1-6,8,10H,7,9,11H2,(H,22,23)
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n/an/an/an/a 1.31E+4n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107288
PNG
(CHEMBL3601057)
Show SMILES Cc1cccc(c1)-c1noc(COc2ccc(CCC(O)=O)cc2Cl)n1
Show InChI InChI=1S/C19H17ClN2O4/c1-12-3-2-4-14(9-12)19-21-17(26-22-19)11-25-16-7-5-13(10-15(16)20)6-8-18(23)24/h2-5,7,9-10H,6,8,11H2,1H3,(H,23,24)
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n/an/an/an/a 4.58E+3n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107289
PNG
(CHEMBL3601056)
Show SMILES CC(Oc1ccc(CCC(O)=O)cc1)c1nc(no1)-c1cccs1
Show InChI InChI=1S/C17H16N2O4S/c1-11(17-18-16(19-23-17)14-3-2-10-24-14)22-13-7-4-12(5-8-13)6-9-15(20)21/h2-5,7-8,10-11H,6,9H2,1H3,(H,20,21)
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n/an/an/an/a 4.00E+3n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107290
PNG
(CHEMBL3601055)
Show SMILES COc1cccc(c1)-c1noc(COc2ccc(CCC(O)=O)cc2Cl)n1
Show InChI InChI=1S/C19H17ClN2O5/c1-25-14-4-2-3-13(10-14)19-21-17(27-22-19)11-26-16-7-5-12(9-15(16)20)6-8-18(23)24/h2-5,7,9-10H,6,8,11H2,1H3,(H,23,24)
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n/an/an/an/a 3.00E+3n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107291
PNG
(CHEMBL3601054)
Show SMILES COc1cccc(c1)-c1noc(COc2ccc(CCC(O)=O)cc2)n1
Show InChI InChI=1S/C19H18N2O5/c1-24-16-4-2-3-14(11-16)19-20-17(26-21-19)12-25-15-8-5-13(6-9-15)7-10-18(22)23/h2-6,8-9,11H,7,10,12H2,1H3,(H,22,23)
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n/an/an/an/a 2.67E+3n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107292
PNG
(CHEMBL3601053)
Show SMILES OC(=O)CCc1ccc(OCc2noc(n2)-c2ccccc2)cc1
Show InChI InChI=1S/C18H16N2O4/c21-17(22)11-8-13-6-9-15(10-7-13)23-12-16-19-18(24-20-16)14-4-2-1-3-5-14/h1-7,9-10H,8,11-12H2,(H,21,22)
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n/an/an/an/a 2.65E+3n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107293
PNG
(CHEMBL3601052)
Show SMILES OC(=O)CCc1ccc(OCc2nc(no2)-c2cccs2)cc1
Show InChI InChI=1S/C16H14N2O4S/c19-15(20)8-5-11-3-6-12(7-4-11)21-10-14-17-16(18-22-14)13-2-1-9-23-13/h1-4,6-7,9H,5,8,10H2,(H,19,20)
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n/an/an/an/a 2.57E+3n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107294
PNG
(CHEMBL3601051)
Show SMILES CC(Oc1ccc(CCC(O)=O)cc1)c1nc(no1)-c1ccccc1
Show InChI InChI=1S/C19H18N2O4/c1-13(19-20-18(21-25-19)15-5-3-2-4-6-15)24-16-10-7-14(8-11-16)9-12-17(22)23/h2-8,10-11,13H,9,12H2,1H3,(H,22,23)
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n/an/an/an/a 2.39E+3n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107295
PNG
(CHEMBL3601050)
Show SMILES Cc1cc(ccc1F)-c1noc(COc2ccc(CCC(O)=O)cc2)n1
Show InChI InChI=1S/C19H17FN2O4/c1-12-10-14(5-8-16(12)20)19-21-17(26-22-19)11-25-15-6-2-13(3-7-15)4-9-18(23)24/h2-3,5-8,10H,4,9,11H2,1H3,(H,23,24)
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n/an/an/an/a 2.12E+3n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107297
PNG
(CHEMBL3601049)
Show SMILES OC(=O)CCc1ccc(OCc2nc(no2)-c2cccc(Br)c2)cc1
Show InChI InChI=1S/C18H15BrN2O4/c19-14-3-1-2-13(10-14)18-20-16(25-21-18)11-24-15-7-4-12(5-8-15)6-9-17(22)23/h1-5,7-8,10H,6,9,11H2,(H,22,23)
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n/an/an/an/a 1.26E+3n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107298
PNG
(CHEMBL3601008)
Show SMILES OC(=O)CCc1ccc(OCc2nc(no2)-c2ccccc2Cl)cc1
Show InChI InChI=1S/C18H15ClN2O4/c19-15-4-2-1-3-14(15)18-20-16(25-21-18)11-24-13-8-5-12(6-9-13)7-10-17(22)23/h1-6,8-9H,7,10-11H2,(H,22,23)
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n/an/an/an/a 1.20E+3n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107299
PNG
(CHEMBL3601007)
Show SMILES OC(=O)CCc1ccc(OCc2nc(no2)-c2ccccc2)cc1
Show InChI InChI=1S/C18H16N2O4/c21-17(22)11-8-13-6-9-15(10-7-13)23-12-16-19-18(20-24-16)14-4-2-1-3-5-14/h1-7,9-10H,8,11-12H2,(H,21,22)
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n/an/an/an/a 1.13E+3n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107300
PNG
(CHEMBL3601006)
Show SMILES OC(=O)CCc1ccc(OCc2nc(no2)-c2cccc(c2)C(F)(F)F)cc1
Show InChI InChI=1S/C19H15F3N2O4/c20-19(21,22)14-3-1-2-13(10-14)18-23-16(28-24-18)11-27-15-7-4-12(5-8-15)6-9-17(25)26/h1-5,7-8,10H,6,9,11H2,(H,25,26)
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n/an/an/an/a 1.11E+3n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107301
PNG
(CHEMBL3601005)
Show SMILES OC(=O)CCc1ccc(OCc2nc(no2)-c2ccc(F)cc2)cc1
Show InChI InChI=1S/C18H15FN2O4/c19-14-6-4-13(5-7-14)18-20-16(25-21-18)11-24-15-8-1-12(2-9-15)3-10-17(22)23/h1-2,4-9H,3,10-11H2,(H,22,23)
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n/an/an/an/a 680n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107302
PNG
(CHEMBL3601004)
Show SMILES OC(=O)CCc1ccc(OCc2nc(no2)-c2ccc(cc2)C(F)(F)F)cc1
Show InChI InChI=1S/C19H15F3N2O4/c20-19(21,22)14-6-4-13(5-7-14)18-23-16(28-24-18)11-27-15-8-1-12(2-9-15)3-10-17(25)26/h1-2,4-9H,3,10-11H2,(H,25,26)
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n/an/an/an/a 610n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107303
PNG
(CHEMBL3601003)
Show SMILES OC(=O)CCc1ccc(OCc2nc(no2)-c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C18H15ClN2O4/c19-14-6-4-13(5-7-14)18-20-16(25-21-18)11-24-15-8-1-12(2-9-15)3-10-17(22)23/h1-2,4-9H,3,10-11H2,(H,22,23)
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n/an/an/an/a 540n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107304
PNG
(CHEMBL3601002)
Show SMILES CC(Oc1ccc(CCC(O)=O)cc1)c1nc(no1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C19H17ClN2O4/c1-12(25-16-9-2-13(3-10-16)4-11-17(23)24)19-21-18(22-26-19)14-5-7-15(20)8-6-14/h2-3,5-10,12H,4,11H2,1H3,(H,23,24)
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n/an/an/an/a 500n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107305
PNG
(CHEMBL3601001)
Show SMILES Cc1ccc(cc1)-c1noc(COc2ccc(CCC(O)=O)cc2)n1
Show InChI InChI=1S/C19H18N2O4/c1-13-2-7-15(8-3-13)19-20-17(25-21-19)12-24-16-9-4-14(5-10-16)6-11-18(22)23/h2-5,7-10H,6,11-12H2,1H3,(H,22,23)
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n/an/an/an/a 300n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107306
PNG
(CHEMBL3601000)
Show SMILES CCc1ccc(cc1)-c1noc(COc2ccc(CCC(O)=O)cc2)n1
Show InChI InChI=1S/C20H20N2O4/c1-2-14-3-8-16(9-4-14)20-21-18(26-22-20)13-25-17-10-5-15(6-11-17)7-12-19(23)24/h3-6,8-11H,2,7,12-13H2,1H3,(H,23,24)
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n/an/an/an/a 210n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107307
PNG
(CHEMBL3600999)
Show SMILES OC(=O)CCc1ccc(OCc2ncc(o2)-c2cccc(Cl)c2)cc1
Show InChI InChI=1S/C19H16ClNO4/c20-15-3-1-2-14(10-15)17-11-21-18(25-17)12-24-16-7-4-13(5-8-16)6-9-19(22)23/h1-5,7-8,10-11H,6,9,12H2,(H,22,23)
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n/an/an/an/a 4.75E+4n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107309
PNG
(CHEMBL3600998)
Show SMILES OC(=O)CCc1ccc(OCc2ncc(o2)-c2ccccc2)cc1
Show InChI InChI=1S/C19H17NO4/c21-19(22)11-8-14-6-9-16(10-7-14)23-13-18-20-12-17(24-18)15-4-2-1-3-5-15/h1-7,9-10,12H,8,11,13H2,(H,21,22)
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n/an/an/an/a 1.60E+3n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107310
PNG
(CHEMBL3600997)
Show SMILES OC(=O)CCc1ccc(OCc2ncc(o2)-c2cccc(F)c2)cc1
Show InChI InChI=1S/C19H16FNO4/c20-15-3-1-2-14(10-15)17-11-21-18(25-17)12-24-16-7-4-13(5-8-16)6-9-19(22)23/h1-5,7-8,10-11H,6,9,12H2,(H,22,23)
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n/an/an/an/a 1.07E+3n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107311
PNG
(CHEMBL3600996)
Show SMILES OC(=O)CCc1ccc(OCc2coc(n2)-c2ccccc2)cc1
Show InChI InChI=1S/C19H17NO4/c21-18(22)11-8-14-6-9-17(10-7-14)23-12-16-13-24-19(20-16)15-4-2-1-3-5-15/h1-7,9-10,13H,8,11-12H2,(H,21,22)
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n/an/an/an/a 700n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107312
PNG
(CHEMBL3600995)
Show SMILES OC(=O)CCc1ccc(OCc2coc(n2)-c2cccc(F)c2)cc1
Show InChI InChI=1S/C19H16FNO4/c20-15-3-1-2-14(10-15)19-21-16(12-25-19)11-24-17-7-4-13(5-8-17)6-9-18(22)23/h1-5,7-8,10,12H,6,9,11H2,(H,22,23)
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n/an/an/an/a 560n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107313
PNG
(CHEMBL3600994)
Show SMILES OC(=O)CCc1ccc(OCc2coc(n2)-c2cccc(Cl)c2)cc1
Show InChI InChI=1S/C19H16ClNO4/c20-15-3-1-2-14(10-15)19-21-16(12-25-19)11-24-17-7-4-13(5-8-17)6-9-18(22)23/h1-5,7-8,10,12H,6,9,11H2,(H,22,23)
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n/an/an/an/a 160n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107314
PNG
(CHEMBL3600993)
Show SMILES Cc1oc(nc1COc1ccc(CCC(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C20H19NO4/c1-14-18(21-20(25-14)16-5-3-2-4-6-16)13-24-17-10-7-15(8-11-17)9-12-19(22)23/h2-8,10-11H,9,12-13H2,1H3,(H,22,23)
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n/an/an/an/a 58n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107315
PNG
(CHEMBL3601061)
Show SMILES OC(=O)Cc1ccc(OCc2nc(no2)-c2cccc(Cl)c2)cc1
Show InChI InChI=1S/C17H13ClN2O4/c18-13-3-1-2-12(9-13)17-19-15(24-20-17)10-23-14-6-4-11(5-7-14)8-16(21)22/h1-7,9H,8,10H2,(H,21,22)
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n/an/an/an/a 1.88E+4n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 3


(Homo sapiens)
BDBM50107314
PNG
(CHEMBL3600993)
Show SMILES Cc1oc(nc1COc1ccc(CCC(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C20H19NO4/c1-14-18(21-20(25-14)16-5-3-2-4-6-16)13-24-17-10-7-15(8-11-17)9-12-19(22)23/h2-8,10-11H,9,12-13H2,1H3,(H,22,23)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR41 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 3


(Homo sapiens)
BDBM50107305
PNG
(CHEMBL3601001)
Show SMILES Cc1ccc(cc1)-c1noc(COc2ccc(CCC(O)=O)cc2)n1
Show InChI InChI=1S/C19H18N2O4/c1-13-2-7-15(8-3-13)19-20-17(25-21-19)12-24-16-9-4-14(5-10-16)6-11-18(22)23/h2-5,7-10H,6,11-12H2,1H3,(H,22,23)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR41 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 3


(Homo sapiens)
BDBM50107303
PNG
(CHEMBL3601003)
Show SMILES OC(=O)CCc1ccc(OCc2nc(no2)-c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C18H15ClN2O4/c19-14-6-4-13(5-7-14)18-20-16(25-21-18)11-24-15-8-1-12(2-9-15)3-10-17(22)23/h1-2,4-9H,3,10-11H2,(H,22,23)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR41 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 2


(Homo sapiens)
BDBM50107314
PNG
(CHEMBL3600993)
Show SMILES Cc1oc(nc1COc1ccc(CCC(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C20H19NO4/c1-14-18(21-20(25-14)16-5-3-2-4-6-16)13-24-17-10-7-15(8-11-17)9-12-19(22)23/h2-8,10-11H,9,12-13H2,1H3,(H,22,23)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR43 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 2


(Homo sapiens)
BDBM50107305
PNG
(CHEMBL3601001)
Show SMILES Cc1ccc(cc1)-c1noc(COc2ccc(CCC(O)=O)cc2)n1
Show InChI InChI=1S/C19H18N2O4/c1-13-2-7-15(8-3-13)19-20-17(25-21-19)12-24-16-9-4-14(5-10-16)6-11-18(22)23/h2-5,7-10H,6,11-12H2,1H3,(H,22,23)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR43 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 2


(Homo sapiens)
BDBM50107303
PNG
(CHEMBL3601003)
Show SMILES OC(=O)CCc1ccc(OCc2nc(no2)-c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C18H15ClN2O4/c19-14-6-4-13(5-7-14)18-20-16(25-21-18)11-24-15-8-1-12(2-9-15)3-10-17(22)23/h1-2,4-9H,3,10-11H2,(H,22,23)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR43 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50107314
PNG
(CHEMBL3600993)
Show SMILES Cc1oc(nc1COc1ccc(CCC(O)=O)cc1)-c1ccccc1
Show InChI InChI=1S/C20H19NO4/c1-14-18(21-20(25-14)16-5-3-2-4-6-16)13-24-17-10-7-15(8-11-17)9-12-19(22)23/h2-8,10-11H,9,12-13H2,1H3,(H,22,23)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR120 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50107305
PNG
(CHEMBL3601001)
Show SMILES Cc1ccc(cc1)-c1noc(COc2ccc(CCC(O)=O)cc2)n1
Show InChI InChI=1S/C19H18N2O4/c1-13-2-7-15(8-3-13)19-20-17(25-21-19)12-24-16-9-4-14(5-10-16)6-11-18(22)23/h2-5,7-10H,6,11-12H2,1H3,(H,22,23)
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n/an/an/an/a>1.00E+4n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR120 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (human))
BDBM50107286
PNG
(CHEMBL3601059)
Show SMILES OC(=O)CCc1ccc(OCc2nc(no2)-c2cccc(c2)C(F)(F)F)c(Cl)c1
Show InChI InChI=1S/C19H14ClF3N2O4/c20-14-8-11(5-7-17(26)27)4-6-15(14)28-10-16-24-18(25-29-16)12-2-1-3-13(9-12)19(21,22)23/h1-4,6,8-9H,5,7,10H2,(H,26,27)
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n/an/an/an/a 3.01E+4n/an/an/an/a



Enamine Ltd

Curated by ChEMBL


Assay Description
Agonist activity at GPR40 (unknown origin) expressed in CHO cells by FLIPR calcium flux assay in presence of 0.1% bovine serum albumin


Bioorg Med Chem Lett 25: 3105-11 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.018
BindingDB Entry DOI: 10.7270/Q26D5VS5
More data for this
Ligand-Target Pair