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PubMed code 26774923

Compile data set for download or QSAR
Found 26 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))		BDBM50143047
PNG
(CHEMBL3758511)
Show SMILES CCOC(=O)CCCCCOc1ccc2cc(CC3SC(=O)NC3=O)ccc2c1
Show InChI InChI=1S/C24H19N7O2/c25-24-27-21-20(23(33)28-24)29-31(30-21)19-8-4-7-18(13-19)22(32)26-14-15-9-11-17(12-10-15)16-5-2-1-3-6-16/h1-13H,14H2,(H,26,32)(H3,25,27,28,30,33)
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n/an/a 6.30E+3n/an/an/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Modulation of FFAR1 (unknown origin)

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50412913
PNG
(CHEMBL448569)
Show SMILES CCCCCCCCc1sc(=O)[nH]c1O
Show InChI InChI=1S/C11H19NO2S/c1-2-3-4-5-6-7-8-9-10(13)12-11(14)15-9/h13H,2-8H2,1H3,(H,12,14)
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n/an/a 7.90E+3n/an/an/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Modulation of FFAR1 (unknown origin)

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50143020
PNG
(CHEMBL3759922)
Show SMILES Cc1ccccc1-c1cccc(COc2ccc(CC3SC(=O)NC3=O)cc2)c1
Show InChI InChI=1S/C24H21NO3S/c1-16-5-2-3-8-21(16)19-7-4-6-18(13-19)15-28-20-11-9-17(10-12-20)14-22-23(26)25-24(27)29-22/h2-13,22H,14-15H2,1H3,(H,25,26,27)
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n/an/an/an/a 7.73E+3n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50143023
PNG
(CHEMBL3758553)
Show SMILES FC(F)(F)c1ccc(cc1)-c1cccc(COc2ccc(CC3SC(=O)NC3=O)cc2)c1
Show InChI InChI=1S/C24H18F3NO3S/c25-24(26,27)19-8-6-17(7-9-19)18-3-1-2-16(12-18)14-31-20-10-4-15(5-11-20)13-21-22(29)28-23(30)32-21/h1-12,21H,13-14H2,(H,28,29,30)
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n/an/an/an/a 6.11E+3n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50143045
PNG
(CHEMBL3758885)
Show SMILES C=CCn1c(COc2ccc(CC3SC(=O)NC3=O)cc2)nc2ccccc12
Show InChI InChI=1S/C14H15N7O3/c15-14-17-11-10(13(24)18-14)19-21(20-11)9-4-1-3-8(7-9)12(23)16-5-2-6-22/h1,3-4,7,22H,2,5-6H2,(H,16,23)(H3,15,17,18,20,24)
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n/an/an/an/a 2.10E+4n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50269532
PNG
((6,9,12)-linolenic acid | (6Z,9Z,12Z)-octadeca-6,9...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/CCCCC(O)=O
Show InChI InChI=1S/C18H30O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10,12-13H,2-5,8,11,14-17H2,1H3,(H,19,20)/b7-6-,10-9-,13-12-
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n/an/an/an/a 4.62E+3n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50030474
PNG
(Avandamet | Avandaryl | Avandia | BRL-49653 | CHEB...)
Show SMILES CN(CCOc1ccc(CC2SC(=O)NC2=O)cc1)c1ccccn1
Show InChI InChI=1S/C18H19N3O3S/c1-21(16-4-2-3-9-19-16)10-11-24-14-7-5-13(6-8-14)12-15-17(22)20-18(23)25-15/h2-9,15H,10-12H2,1H3,(H,20,22,23)
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n/an/an/an/a 240n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Transactivation of N-terminal Gal4 DNA binding domain-linked human PPARalpha ligand binding domain after 24 hrs by luciferase reporter gene assay rel...

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50145471
PNG
(5-(4-(benzyloxy)benzyl)thiazolidine-2,4-dione | 5-...)
Show SMILES Oc1[nH]c(=O)sc1Cc1ccc(OCc2ccccc2)cc1
Show InChI InChI=1S/C17H15NO3S/c19-16-15(22-17(20)18-16)10-12-6-8-14(9-7-12)21-11-13-4-2-1-3-5-13/h1-9,19H,10-11H2,(H,18,20)
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n/an/an/an/a 6.56E+3n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50143030
PNG
(CHEMBL3759746)
Show SMILES FC(F)(F)c1ccc(O[C@@H](CCOc2ccc(CC3SC(=O)NC3=O)cc2)c2ccccc2)cc1 |r|
Show InChI InChI=1S/C26H22F3NO4S/c27-26(28,29)19-8-12-21(13-9-19)34-22(18-4-2-1-3-5-18)14-15-33-20-10-6-17(7-11-20)16-23-24(31)30-25(32)35-23/h1-13,22-23H,14-16H2,(H,30,31,32)/t22-,23?/m0/s1
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n/an/an/an/a 7.42E+3n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50143015
PNG
(CHEMBL3758549)
Show SMILES Brc1cccc(COc2ccc(CC3SC(=O)NC3=O)cc2)c1
Show InChI InChI=1S/C17H14BrNO3S/c18-13-3-1-2-12(8-13)10-22-14-6-4-11(5-7-14)9-15-16(20)19-17(21)23-15/h1-8,15H,9-10H2,(H,19,20,21)
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n/an/an/an/a 3.57E+3n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50143017
PNG
(CHEMBL3759467)
Show SMILES O=C1NC(=O)C(Cc2ccc(OCc3cccc(c3)-c3ccccc3)cc2)S1
Show InChI InChI=1S/C23H19NO3S/c25-22-21(28-23(26)24-22)14-16-9-11-20(12-10-16)27-15-17-5-4-8-19(13-17)18-6-2-1-3-7-18/h1-13,21H,14-15H2,(H,24,25,26)
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n/an/an/an/a 9.91E+3n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50143043
PNG
(CHEMBL3758919)
Show SMILES O=C1NC(=O)C(Cc2ccc(OCc3nc4ccccc4n3Cc3ccccc3)cc2)S1
Show InChI InChI=1S/C18H13Cl2N7O2/c19-11-4-9(5-12(20)7-11)8-22-16(28)10-2-1-3-13(6-10)27-25-14-15(26-27)23-18(21)24-17(14)29/h1-7H,8H2,(H,22,28)(H3,21,23,24,26,29)
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n/an/an/an/a 3.02E+4n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Transactivation of N-terminal Gal4 DNA binding domain-linked human PPARalpha ligand binding domain after 24 hrs by luciferase reporter gene assay rel...

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50143044
PNG
(CHEMBL3758197)
Show SMILES CC(C)Cn1c(COc2ccc(CC3SC(=O)NC3=O)cc2)nc2ccccc12
Show InChI InChI=1S/C7H9N5O2/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14/h1-2H3,(H3,8,9,10)
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n/an/an/an/a 1.32E+4n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Transactivation of N-terminal Gal4 DNA binding domain-linked human PPARalpha ligand binding domain after 24 hrs by luciferase reporter gene assay rel...

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50143044
PNG
(CHEMBL3758197)
Show SMILES CC(C)Cn1c(COc2ccc(CC3SC(=O)NC3=O)cc2)nc2ccccc12
Show InChI InChI=1S/C7H9N5O2/c1-11-4-3(9-6(8)10-4)5(13)12(2)7(11)14/h1-2H3,(H3,8,9,10)
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n/an/an/an/a 1.89E+3n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50143024
PNG
(CHEMBL3759866)
Show SMILES COc1cccc(O[C@@H](CCOc2ccc(CC3SC(=O)NC3=O)cc2)c2ccccc2)c1 |r|
Show InChI InChI=1S/C26H25NO5S/c1-30-21-8-5-9-22(17-21)32-23(19-6-3-2-4-7-19)14-15-31-20-12-10-18(11-13-20)16-24-25(28)27-26(29)33-24/h2-13,17,23-24H,14-16H2,1H3,(H,27,28,29)/t23-,24?/m0/s1
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n/an/an/an/a 1.96E+4n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50143041
PNG
(CHEMBL3759913)
Show SMILES Clc1ccc(O[C@@H](CCOc2ccc(CC3SC(=O)NC3=O)cc2)c2ccccc2)cc1 |r|
Show InChI InChI=1S/C16H19N7O3/c1-16(2,8-24)7-18-13(25)9-4-3-5-10(6-9)23-21-11-12(22-23)19-15(17)20-14(11)26/h3-6,24H,7-8H2,1-2H3,(H,18,25)(H3,17,19,20,22,26)
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n/an/an/an/a 8.51E+3n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50143016
PNG
(CHEMBL3759133)
Show SMILES Brc1ccc(COc2ccc(CC3SC(=O)NC3=O)cc2)cc1
Show InChI InChI=1S/C17H14BrNO3S/c18-13-5-1-12(2-6-13)10-22-14-7-3-11(4-8-14)9-15-16(20)19-17(21)23-15/h1-8,15H,9-10H2,(H,19,20,21)
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n/an/an/an/a 1.70E+4n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Transactivation of N-terminal Gal4 DNA binding domain-linked human PPARalpha ligand binding domain after 24 hrs by luciferase reporter gene assay rel...

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50143046
PNG
(CHEMBL3759448)
Show SMILES CC(C)n1c(COc2ccc(CC3SC(=O)NC3=O)cc2)nc2ccccc12
Show InChI InChI=1S/C19H15N7O4/c20-19-22-16-15(18(28)23-19)24-26(25-16)12-3-1-2-11(7-12)17(27)21-8-10-4-5-13-14(6-10)30-9-29-13/h1-7H,8-9H2,(H,21,27)(H3,20,22,23,25,28)
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n/an/an/an/a 2.54E+4n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Transactivation of N-terminal Gal4 DNA binding domain-linked human PPARalpha ligand binding domain after 24 hrs by luciferase reporter gene assay rel...

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50306393
PNG
(5-(4-(4-fluorophenoxy)benzyl)thiazolidine-2,4-dion...)
Show SMILES Oc1[nH]c(=O)sc1Cc1ccc(Oc2ccc(F)cc2)cc1
Show InChI InChI=1S/C16H12FNO3S/c17-11-3-7-13(8-4-11)21-12-5-1-10(2-6-12)9-14-15(19)18-16(20)22-14/h1-8,19H,9H2,(H,18,20)
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n/an/an/an/a 500n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Partial agonist activity at human GPR40 expressed in CHO cells assessed as fatty acid-induced calcium mobilization by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50143022
PNG
(CHEMBL3759212)
Show SMILES Cc1cccc(C)c1-c1cccc(COc2ccc(CC3SC(=O)NC3=O)cc2)c1
Show InChI InChI=1S/C25H23NO3S/c1-16-5-3-6-17(2)23(16)20-8-4-7-19(13-20)15-29-21-11-9-18(10-12-21)14-22-24(27)26-25(28)30-22/h3-13,22H,14-15H2,1-2H3,(H,26,27,28)
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n/an/an/an/a 1.15E+3n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50143042
PNG
(CHEMBL3758719)
Show SMILES Clc1ccc(O[C@@H](CCOc2ccc(CC3SC(=O)NC3=O)cc2)c2ccccc2)c(Cl)c1 |r|
Show InChI InChI=1S/C18H21N7O3/c19-18-21-15-14(17(28)22-18)23-25(24-15)12-6-3-5-10(8-12)16(27)20-9-11-4-1-2-7-13(11)26/h3,5-6,8,11,13,26H,1-2,4,7,9H2,(H,20,27)(H3,19,21,22,24,28)/t11-,13-/m1/s1
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n/an/an/an/a 1.66E+3n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50143043
PNG
(CHEMBL3758919)
Show SMILES O=C1NC(=O)C(Cc2ccc(OCc3nc4ccccc4n3Cc3ccccc3)cc2)S1
Show InChI InChI=1S/C18H13Cl2N7O2/c19-11-4-9(5-12(20)7-11)8-22-16(28)10-2-1-3-13(6-10)27-25-14-15(26-27)23-18(21)24-17(14)29/h1-7H,8H2,(H,22,28)(H3,21,23,24,26,29)
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n/an/an/an/a 4.11E+3n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50143046
PNG
(CHEMBL3759448)
Show SMILES CC(C)n1c(COc2ccc(CC3SC(=O)NC3=O)cc2)nc2ccccc12
Show InChI InChI=1S/C19H15N7O4/c20-19-22-16-15(18(28)23-19)24-26(25-16)12-3-1-2-11(7-12)17(27)21-8-10-4-5-13-14(6-10)30-9-29-13/h1-7H,8-9H2,(H,21,27)(H3,20,22,23,25,28)
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n/an/an/an/a 1.66E+4n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))		BDBM50143016
PNG
(CHEMBL3759133)
Show SMILES Brc1ccc(COc2ccc(CC3SC(=O)NC3=O)cc2)cc1
Show InChI InChI=1S/C17H14BrNO3S/c18-13-5-1-12(2-6-13)10-22-14-7-3-11(4-8-14)9-15-16(20)19-17(21)23-15/h1-8,15H,9-10H2,(H,19,20,21)
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n/an/an/an/a 2.31E+4n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Agonist activity at human FFAR1 expressed in CHO-K1 cells assessed as calcium flux measured for 100 secs by FLIPR assay

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50143015
PNG
(CHEMBL3758549)
Show SMILES Brc1cccc(COc2ccc(CC3SC(=O)NC3=O)cc2)c1
Show InChI InChI=1S/C17H14BrNO3S/c18-13-3-1-2-12(8-13)10-22-14-6-4-11(5-7-14)9-15-16(20)19-17(21)23-15/h1-8,15H,9-10H2,(H,19,20,21)
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n/an/an/an/a 2.52E+4n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Transactivation of N-terminal Gal4 DNA binding domain-linked human PPARalpha ligand binding domain after 24 hrs by luciferase reporter gene assay rel...

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor alpha


(Homo sapiens (Human))		BDBM50143045
PNG
(CHEMBL3758885)
Show SMILES C=CCn1c(COc2ccc(CC3SC(=O)NC3=O)cc2)nc2ccccc12
Show InChI InChI=1S/C14H15N7O3/c15-14-17-11-10(13(24)18-14)19-21(20-11)9-4-1-3-8(7-9)12(23)16-5-2-6-22/h1,3-4,7,22H,2,5-6H2,(H,16,23)(H3,15,17,18,20,24)
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n/an/an/an/a 4.93E+3n/an/an/an/a



Suez Canal University

Curated by ChEMBL


Assay Description
Transactivation of N-terminal Gal4 DNA binding domain-linked human PPARalpha ligand binding domain after 24 hrs by luciferase reporter gene assay rel...

Eur J Med Chem 109: 157-72 (2016)


Article DOI: 10.1016/j.ejmech.2015.12.049
BindingDB Entry DOI: 10.7270/Q2FJ2JMM
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%