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Compile Data Set for Download or QSAR

Found 519 hits Enz. Inhib. hit(s) with Target = 'Free fatty acid receptor 4' AND taxid = 9606   
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 4


(Homo sapiens)
BDBM50044874
PNG
(CHEMBL3311302)
Show SMILES Cc1ccc(cc1)S(=O)(=O)NC1c2ccccc2Oc2ccccc12
Show InChI InChI=1S/C20H17NO3S/c1-14-10-12-15(13-11-14)25(22,23)21-20-16-6-2-4-8-18(16)24-19-9-5-3-7-17(19)20/h2-13,20-21H,1H3
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Article
PubMed
n/an/a 79n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibition of human FFA4 receptor expressed in U2OS cells


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50196324
PNG
(CHEMBL3945213)
Show SMILES Fc1cc(Oc2ccccc2)cc(c1)N1Cc2ccccc2S1(=O)=O
Show InChI InChI=1S/C19H14FNO3S/c20-15-10-16(12-18(11-15)24-17-7-2-1-3-8-17)21-13-14-6-4-5-9-19(14)25(21,22)23/h1-12H,13H2
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n/an/a<1.00E+4n/an/an/an/an/an/a



University of Southern Denmark

Curated by ChEMBL


Assay Description
Agonist activity at C-terminal YFP-tagged human FFA4 expressed in HEK293 cells in presence of coelentrazine h by BRET based beta-arrestin-2 interacti...


J Med Chem 59: 8868-8878 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00685
BindingDB Entry DOI: 10.7270/Q2C53NS2
More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261524
PNG
(US9708270, 19)
Show SMILES Cc1cc(C)cc(c1)N1CCC2(CCC(CC(O)=O)CC2)CC1
Show InChI InChI=1S/C20H29NO2/c1-15-11-16(2)13-18(12-15)21-9-7-20(8-10-21)5-3-17(4-6-20)14-19(22)23/h11-13,17H,3-10,14H2,1-2H3,(H,22,23)
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n/an/an/an/a 948n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261525
PNG
(US9708270, 20)
Show SMILES CCC(=O)c1ccc(F)c(c1)N1CCC2(CCC(CC(O)=O)CC2)CC1
Show InChI InChI=1S/C21H28FNO3/c1-2-19(24)16-3-4-17(22)18(14-16)23-11-9-21(10-12-23)7-5-15(6-8-21)13-20(25)26/h3-4,14-15H,2,5-13H2,1H3,(H,25,26)
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n/an/an/an/a 1.66E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261526
PNG
(US9708270, 21)
Show SMILES OC(=O)CC1CCC2(CC1)CCN(CC2)c1cc(ccc1C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C20H23F6NO2/c21-19(22,23)14-1-2-15(20(24,25)26)16(12-14)27-9-7-18(8-10-27)5-3-13(4-6-18)11-17(28)29/h1-2,12-13H,3-11H2,(H,28,29)
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n/an/an/an/a 3.27E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261527
PNG
(US9708270, 22)
Show SMILES OC(=O)CC1CCC2(CC1)CCN(CC2)c1cc(cc(c1)C(F)F)C(F)F
Show InChI InChI=1S/C20H25F4NO2/c21-18(22)14-10-15(19(23)24)12-16(11-14)25-7-5-20(6-8-25)3-1-13(2-4-20)9-17(26)27/h10-13,18-19H,1-9H2,(H,26,27)
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n/an/an/an/a 3.01E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261528
PNG
(US9708270, 23)
Show SMILES CC(C)(C)c1cc(cc(c1)C(F)(F)F)N1CCC2(CCC(CC(O)=O)CC2)CC1
Show InChI InChI=1S/C23H32F3NO2/c1-21(2,3)17-13-18(23(24,25)26)15-19(14-17)27-10-8-22(9-11-27)6-4-16(5-7-22)12-20(28)29/h13-16H,4-12H2,1-3H3,(H,28,29)
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n/an/an/an/a 3.75E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261529
PNG
(US9708270, 24)
Show SMILES CC(C)c1cc(cc(c1)N1CCC2(CCC(CC(O)=O)CC2)CC1)C#N
Show InChI InChI=1S/C22H30N2O2/c1-16(2)19-11-18(15-23)12-20(14-19)24-9-7-22(8-10-24)5-3-17(4-6-22)13-21(25)26/h11-12,14,16-17H,3-10,13H2,1-2H3,(H,25,26)
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n/an/an/an/a 3.46E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM50208093
PNG
(CHEMBL3953289 | US9708270, 25)
Show SMILES OC(=O)CC1CCC2(CC1)CCN(CC2)c1cc(SC(F)(F)F)cc(c1)C#N
Show InChI InChI=1S/C20H23F3N2O2S/c21-20(22,23)28-17-10-15(13-24)9-16(12-17)25-7-5-19(6-8-25)3-1-14(2-4-19)11-18(26)27/h9-10,12,14H,1-8,11H2,(H,26,27)
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n/an/an/an/a 1.15E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261531
PNG
(US9708270, 26)
Show SMILES CSc1nc(cc(n1)C(F)(F)F)N1CCC2(CCC(CC(O)=O)CC2)CC1
Show InChI InChI=1S/C18H24F3N3O2S/c1-27-16-22-13(18(19,20)21)11-14(23-16)24-8-6-17(7-9-24)4-2-12(3-5-17)10-15(25)26/h11-12H,2-10H2,1H3,(H,25,26)
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n/an/an/an/a 8.30E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261532
PNG
(US9708270, 27)
Show SMILES OC(=O)CC1CCC2(CC1)CCN(CC2)c1cc(cc(n1)C(F)F)C(F)F
Show InChI InChI=1S/C19H24F4N2O2/c20-17(21)13-10-14(18(22)23)24-15(11-13)25-7-5-19(6-8-25)3-1-12(2-4-19)9-16(26)27/h10-12,17-18H,1-9H2,(H,26,27)
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n/an/an/an/a 2.99E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261533
PNG
(US9708270, 28)
Show SMILES Cc1cc(F)cc(c1)N1CCC2(CCC(CC(O)=O)CC2)CC1
Show InChI InChI=1S/C19H26FNO2/c1-14-10-16(20)13-17(11-14)21-8-6-19(7-9-21)4-2-15(3-5-19)12-18(22)23/h10-11,13,15H,2-9,12H2,1H3,(H,22,23)
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n/an/an/an/a 3.04E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261534
PNG
(US9708270, 29)
Show SMILES OC(=O)CC1CCC2(CC1)CCN(CC2)c1cc(F)cc(Cl)c1
Show InChI InChI=1S/C18H23ClFNO2/c19-14-10-15(20)12-16(11-14)21-7-5-18(6-8-21)3-1-13(2-4-18)9-17(22)23/h10-13H,1-9H2,(H,22,23)
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n/an/an/an/a 1.79E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM50208157
PNG
(CHEMBL3893026 | US9708270, 30)
Show SMILES OC(=O)CC1CCC2(CC1)CCN(CC2)c1cc(Cl)cc(Cl)c1
Show InChI InChI=1S/C18H23Cl2NO2/c19-14-10-15(20)12-16(11-14)21-7-5-18(6-8-21)3-1-13(2-4-18)9-17(22)23/h10-13H,1-9H2,(H,22,23)
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n/an/an/an/a 878n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261510
PNG
(US9708270, 6)
Show SMILES COc1cc(F)c(cc1F)N1CCC2(CCC(CC(O)=O)CC2)CC1
Show InChI InChI=1S/C19H25F2NO3/c1-25-17-12-14(20)16(11-15(17)21)22-8-6-19(7-9-22)4-2-13(3-5-19)10-18(23)24/h11-13H,2-10H2,1H3,(H,23,24)
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n/an/an/an/a 2.42E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM50208148
PNG
(CHEMBL3891920 | US9708270, 7)
Show SMILES OC(=O)CC1CCC2(CC1)CCN(CC2)c1cc(OC(F)(F)F)ccc1F
Show InChI InChI=1S/C19H23F4NO3/c20-15-2-1-14(27-19(21,22)23)12-16(15)24-9-7-18(8-10-24)5-3-13(4-6-18)11-17(25)26/h1-2,12-13H,3-11H2,(H,25,26)
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n/an/an/an/a 410n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM50208084
PNG
(CHEMBL3977361 | US9708270, 8)
Show SMILES COc1ccc(Cl)c(c1)N1CCC2(CCC(CC(O)=O)CC2)CC1
Show InChI InChI=1S/C19H26ClNO3/c1-24-15-2-3-16(20)17(13-15)21-10-8-19(9-11-21)6-4-14(5-7-19)12-18(22)23/h2-3,13-14H,4-12H2,1H3,(H,22,23)
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n/an/an/an/a 1.67E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261514
PNG
(US9708270, 9)
Show SMILES Cc1ccc(Cl)c(c1)N1CCC2(CCC(CC(O)=O)CC2)CC1
Show InChI InChI=1S/C19H26ClNO2/c1-14-2-3-16(20)17(12-14)21-10-8-19(9-11-21)6-4-15(5-7-19)13-18(22)23/h2-3,12,15H,4-11,13H2,1H3,(H,22,23)
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n/an/an/an/a 2.18E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261515
PNG
(US9708270, 10)
Show SMILES OC(=O)CC1CCC2(CC1)CCN(CC2)c1cc(ccc1Cl)[N+]([O-])=O
Show InChI InChI=1S/C18H23ClN2O4/c19-15-2-1-14(21(24)25)12-16(15)20-9-7-18(8-10-20)5-3-13(4-6-18)11-17(22)23/h1-2,12-13H,3-11H2,(H,22,23)
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n/an/an/an/a 1.70E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM50208149
PNG
(CHEMBL3937916 | US9708270, 11)
Show SMILES CC1(C)Cc2cc(Cl)cc(N3CCC4(CCC(CC(O)=O)CC4)CC3)c2O1
Show InChI InChI=1S/C22H30ClNO3/c1-21(2)14-16-12-17(23)13-18(20(16)27-21)24-9-7-22(8-10-24)5-3-15(4-6-22)11-19(25)26/h12-13,15H,3-11,14H2,1-2H3,(H,25,26)
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n/an/an/an/a 2.85E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261517
PNG
(US9708270, 12)
Show SMILES OC(=O)CC1CCC2(CC1)CCN(CC2)c1cc(F)ccc1C(F)F
Show InChI InChI=1S/C19H24F3NO2/c20-14-1-2-15(18(21)22)16(12-14)23-9-7-19(8-10-23)5-3-13(4-6-19)11-17(24)25/h1-2,12-13,18H,3-11H2,(H,24,25)
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n/an/an/an/a 2.42E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261518
PNG
(US9708270, 13)
Show SMILES Cc1ccc(C#N)c(c1)N1CCC2(CCC(CC(O)=O)CC2)CC1
Show InChI InChI=1S/C20H26N2O2/c1-15-2-3-17(14-21)18(12-15)22-10-8-20(9-11-22)6-4-16(5-7-20)13-19(23)24/h2-3,12,16H,4-11,13H2,1H3,(H,23,24)
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n/an/an/an/a 2.14E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261519
PNG
(US9708270, 14)
Show SMILES COc1ccc(Cl)cc1N1CCC2(CCC(CC(O)=O)CC2)CC1
Show InChI InChI=1S/C19H26ClNO3/c1-24-17-3-2-15(20)13-16(17)21-10-8-19(9-11-21)6-4-14(5-7-19)12-18(22)23/h2-3,13-14H,4-12H2,1H3,(H,22,23)
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n/an/an/an/a 3.10E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261520
PNG
(US9708270, 15)
Show SMILES COc1ccc(cc1N1CCC2(CCC(CC(O)=O)CC2)CC1)C(F)(F)F
Show InChI InChI=1S/C20H26F3NO3/c1-27-17-3-2-15(20(21,22)23)13-16(17)24-10-8-19(9-11-24)6-4-14(5-7-19)12-18(25)26/h2-3,13-14H,4-12H2,1H3,(H,25,26)
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n/an/an/an/a 2.36E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM50208150
PNG
(CHEMBL3947837 | US9708270, 16)
Show SMILES OC(=O)CC1CCC2(CC1)CCN(CC2)c1cc(ccc1F)C(F)(F)F
Show InChI InChI=1S/C19H23F4NO2/c20-15-2-1-14(19(21,22)23)12-16(15)24-9-7-18(8-10-24)5-3-13(4-6-18)11-17(25)26/h1-2,12-13H,3-11H2,(H,25,26)
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n/an/an/an/a 652n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261522
PNG
(US9708270, 17)
Show SMILES OC(=O)CC1CCC2(CC1)CCN(CC2)c1cc(F)ccc1C#N
Show InChI InChI=1S/C19H23FN2O2/c20-16-2-1-15(13-21)17(12-16)22-9-7-19(8-10-22)5-3-14(4-6-19)11-18(23)24/h1-2,12,14H,3-11H2,(H,23,24)
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n/an/an/an/a 2.36E+3n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
G-protein coupled receptor 120


(Homo sapiens)
BDBM261523
PNG
(US9708270, 18)
Show SMILES CC(C)Oc1ccc(Cl)c(c1)N1CCC2(CCC(CC(O)=O)CC2)CC1
Show InChI InChI=1S/C21H30ClNO3/c1-15(2)26-17-3-4-18(22)19(14-17)23-11-9-21(10-12-23)7-5-16(6-8-21)13-20(24)25/h3-4,14-16H,5-13H2,1-2H3,(H,24,25)
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n/an/an/an/a 530n/an/an/an/a



Merck Sharp & Dohme Corp.

US Patent


Assay Description
On the day before the measurement day, CHO cells expressing human GPR120 were plated at 10000 cells per well in a 384-well black plate (#3702, Cornin...


US Patent US9708270 (2017)

More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044846
PNG
(CHEMBL3311324)
Show SMILES COc1ccc(cc1OC)S(=O)(=O)Nc1c(C)cc(C)cc1C
Show InChI InChI=1S/C17H21NO4S/c1-11-8-12(2)17(13(3)9-11)18-23(19,20)14-6-7-15(21-4)16(10-14)22-5/h6-10,18H,1-5H3
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n/an/an/an/a 1.00E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044847
PNG
(CHEMBL3311316)
Show SMILES CC(=O)c1ccc(cc1)S(=O)(=O)Nc1c(C)cc(C)cc1C
Show InChI InChI=1S/C17H19NO3S/c1-11-9-12(2)17(13(3)10-11)18-22(20,21)16-7-5-15(6-8-16)14(4)19/h5-10,18H,1-4H3
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n/an/an/an/a 7.94E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044848
PNG
(CHEMBL3311317)
Show SMILES Cc1cc(C)c(NS(=O)(=O)c2ccc(F)cc2)c(C)c1
Show InChI InChI=1S/C15H16FNO2S/c1-10-8-11(2)15(12(3)9-10)17-20(18,19)14-6-4-13(16)5-7-14/h4-9,17H,1-3H3
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n/an/an/an/a 6.31E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044850
PNG
(CHEMBL3311303)
Show SMILES COC(=O)c1cccc(NS(=O)(=O)c2ccc(C)cc2)c1C
Show InChI InChI=1S/C16H17NO4S/c1-11-7-9-13(10-8-11)22(19,20)17-15-6-4-5-14(12(15)2)16(18)21-3/h4-10,17H,1-3H3
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n/an/an/an/a 3.98E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044851
PNG
(CHEMBL3311306)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1c(C)cccc1C
Show InChI InChI=1S/C15H17NO3S/c1-11-5-4-6-12(2)15(11)16-20(17,18)14-9-7-13(19-3)8-10-14/h4-10,16H,1-3H3
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n/an/an/an/a 3.16E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044852
PNG
(CHEMBL3311318)
Show SMILES Cc1cc(C)c(NS(=O)(=O)c2ccc(Cl)cc2)c(C)c1
Show InChI InChI=1S/C15H16ClNO2S/c1-10-8-11(2)15(12(3)9-10)17-20(18,19)14-6-4-13(16)5-7-14/h4-9,17H,1-3H3
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n/an/an/an/a 3.16E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044853
PNG
(CHEMBL3311305)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1ccc(C)cc1C
Show InChI InChI=1S/C15H17NO3S/c1-11-4-9-15(12(2)10-11)16-20(17,18)14-7-5-13(19-3)6-8-14/h4-10,16H,1-3H3
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n/an/an/an/a 2.51E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044854
PNG
(CHEMBL3311322)
Show SMILES CC(C)Oc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(C)cc1C
Show InChI InChI=1S/C18H23NO3S/c1-12(2)22-16-6-8-17(9-7-16)23(20,21)19-18-14(4)10-13(3)11-15(18)5/h6-12,19H,1-5H3
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n/an/an/an/a 2.00E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044855
PNG
(CHEMBL3311326)
Show SMILES Cc1cc(C)c(NS(=O)(=O)c2ccc3OCCCOc3c2)c(C)c1
Show InChI InChI=1S/C18H21NO4S/c1-12-9-13(2)18(14(3)10-12)19-24(20,21)15-5-6-16-17(11-15)23-8-4-7-22-16/h5-6,9-11,19H,4,7-8H2,1-3H3
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n/an/an/an/a 2.00E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044856
PNG
(CHEMBL3311313)
Show SMILES Cc1cc(C)c(NS(=O)(=O)c2ccc(OC(F)(F)F)cc2)c(C)c1
Show InChI InChI=1S/C16H16F3NO3S/c1-10-8-11(2)15(12(3)9-10)20-24(21,22)14-6-4-13(5-7-14)23-16(17,18)19/h4-9,20H,1-3H3
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n/an/an/an/a 1.26E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044857
PNG
(CA inhibitor, 4 | CHEMBL3311314)
Show SMILES Cc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(C)cc1C
Show InChI InChI=1S/C16H19NO2S/c1-11-5-7-15(8-6-11)20(18,19)17-16-13(3)9-12(2)10-14(16)4/h5-10,17H,1-4H3
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n/an/an/an/a 1.00E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044858
PNG
(CHEMBL3311196)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(F)cc1C
Show InChI InChI=1S/C15H16FNO3S/c1-10-8-12(16)9-11(2)15(10)17-21(18,19)14-6-4-13(20-3)5-7-14/h4-9,17H,1-3H3
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n/an/an/an/a 1.00E+3n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044859
PNG
(CHEMBL1581959)
Show SMILES COc1cc(ccc1Cl)S(=O)(=O)Nc1c(C)cc(C)cc1C
Show InChI InChI=1S/C16H18ClNO3S/c1-10-7-11(2)16(12(3)8-10)18-22(19,20)13-5-6-14(17)15(9-13)21-4/h5-9,18H,1-4H3
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n/an/an/an/a 794n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044849
PNG
(CHEMBL3311308)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(C)cc1C
Show InChI InChI=1S/C16H19NO3S/c1-11-9-12(2)16(13(3)10-11)17-21(18,19)15-7-5-14(20-4)6-8-15/h5-10,17H,1-4H3
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n/an/an/an/a 501n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044860
PNG
(CHEMBL3311197)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(Cl)cc1C
Show InChI InChI=1S/C15H16ClNO3S/c1-10-8-12(16)9-11(2)15(10)17-21(18,19)14-6-4-13(20-3)5-7-14/h4-9,17H,1-3H3
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n/an/an/an/a 501n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044864
PNG
(CHEMBL3311319)
Show SMILES CCCc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(C)cc1C
Show InChI InChI=1S/C18H23NO2S/c1-5-6-16-7-9-17(10-8-16)22(20,21)19-18-14(3)11-13(2)12-15(18)4/h7-12,19H,5-6H2,1-4H3
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n/an/an/an/a 398n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044870
PNG
(CHEMBL3311198)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(OC)cc1C
Show InChI InChI=1S/C16H19NO4S/c1-11-9-14(21-4)10-12(2)16(11)17-22(18,19)15-7-5-13(20-3)6-8-15/h5-10,17H,1-4H3
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n/an/an/an/a 398n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM22231
PNG
((9Z,12Z)-octadeca-9,12-dienoic acid | CHEMBL267476...)
Show SMILES CCCCC\C=C/C\C=C/CCCCCCCC(O)=O
Show InChI InChI=1S/C18H32O2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18(19)20/h6-7,9-10H,2-5,8,11-17H2,1H3,(H,19,20)/b7-6-,10-9-
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n/an/an/an/a 316n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044872
PNG
(CHEMBL3311325)
Show SMILES Cc1cc(C)c(NS(=O)(=O)c2ccc3OCCOc3c2)c(C)c1
Show InChI InChI=1S/C17H19NO4S/c1-11-8-12(2)17(13(3)9-11)18-23(19,20)14-4-5-15-16(10-14)22-7-6-21-15/h4-5,8-10,18H,6-7H2,1-3H3
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n/an/an/an/a 316n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044873
PNG
(CHEMBL3311327)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(CC=C)cc1C
Show InChI InChI=1S/C18H21NO3S/c1-5-6-15-11-13(2)18(14(3)12-15)19-23(20,21)17-9-7-16(22-4)8-10-17/h5,7-12,19H,1,6H2,2-4H3
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n/an/an/an/a 316n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044875
PNG
(CHEMBL3311200)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(cc1C)C(O)=O
Show InChI InChI=1S/C16H17NO5S/c1-10-8-12(16(18)19)9-11(2)15(10)17-23(20,21)14-6-4-13(22-3)5-7-14/h4-9,17H,1-3H3,(H,18,19)
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n/an/an/an/a<3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044882
PNG
(CHEMBL3311201)
Show SMILES COC(=O)c1cc(C)c(NS(=O)(=O)c2ccc(OC)cc2)c(C)c1
Show InChI InChI=1S/C17H19NO5S/c1-11-9-13(17(19)23-4)10-12(2)16(11)18-24(20,21)15-7-5-14(22-3)6-8-15/h5-10,18H,1-4H3
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n/an/an/an/a<3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens)
BDBM50044895
PNG
(CHEMBL3311202)
Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1c(C)cc(CO)cc1C
Show InChI InChI=1S/C16H19NO4S/c1-11-8-13(10-18)9-12(2)16(11)17-22(19,20)15-6-4-14(21-3)5-7-15/h4-9,17-18H,10H2,1-3H3
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UniProtKB/SwissProt

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CHEMBL
PC cid
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PubMed
n/an/an/an/a<3.16E+4n/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 receptor expressed in U2OS cells assessed as calcium mobilization after 24 hrs by FLIPR


Bioorg Med Chem Lett 24: 3100-3 (2014)


Article DOI: 10.1016/j.bmcl.2014.05.012
BindingDB Entry DOI: 10.7270/Q2CC1292
More data for this
Ligand-Target Pair
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