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Compile Data Set for Download or QSAR

Found 161 hits Enz. Inhib. hit(s) with Target = 'G-protein coupled receptor 84'   
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
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189503
PNG
(CHEMBL3828298)
Show SMILES CCCCCCCCCc1cc(O)cc(O)n1
Show InChI InChI=1S/C14H23NO2/c1-2-3-4-5-6-7-8-9-12-10-13(16)11-14(17)15-12/h10-11H,2-9H2,1H3,(H2,15,16,17)
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n/an/an/an/a 0.189n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189503
PNG
(CHEMBL3828298)
Show SMILES CCCCCCCCCc1cc(O)cc(O)n1
Show InChI InChI=1S/C14H23NO2/c1-2-3-4-5-6-7-8-9-12-10-13(16)11-14(17)15-12/h10-11H,2-9H2,1H3,(H2,15,16,17)
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n/an/an/an/a 0.352n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189504
PNG
(CHEMBL3827638)
Show SMILES CCCCCCCCc1cc(O)cc(O)n1
Show InChI InChI=1S/C13H21NO2/c1-2-3-4-5-6-7-8-11-9-12(15)10-13(16)14-11/h9-10H,2-8H2,1H3,(H2,14,15,16)
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n/an/an/an/a 1.30n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189505
PNG
(CHEMBL13302)
Show SMILES CCCCCCCc1cc(O)cc(O)n1
Show InChI InChI=1S/C12H19NO2/c1-2-3-4-5-6-7-10-8-11(14)9-12(15)13-10/h8-9H,2-7H2,1H3,(H2,13,14,15)
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n/an/an/an/a 1.30n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189507
PNG
(CHEMBL3828303)
Show SMILES CCCCCCCCNc1nc(O)cc(O)n1
Show InChI InChI=1S/C12H21N3O2/c1-2-3-4-5-6-7-8-13-12-14-10(16)9-11(17)15-12/h9H,2-8H2,1H3,(H3,13,14,15,16,17)
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n/an/an/an/a 6.10n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189511
PNG
(CHEMBL3827580)
Show SMILES CCCCCCCCc1nc(O)cc(O)n1
Show InChI InChI=1S/C12H20N2O2/c1-2-3-4-5-6-7-8-10-13-11(15)9-12(16)14-10/h9H,2-8H2,1H3,(H2,13,14,15,16)
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n/an/an/an/a 11n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189538
PNG
(CHEMBL3828708)
Show SMILES CCCCCCCc1nc(O)cc(O)n1
Show InChI InChI=1S/C11H18N2O2/c1-2-3-4-5-6-7-9-12-10(14)8-11(15)13-9/h8H,2-7H2,1H3,(H2,12,13,14,15)
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n/an/an/an/a 13n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239172
PNG
(CHEMBL4088884)
Show SMILES Fc1cc(F)c2[nH]cc(Cc3c[nH]c4c(F)cc(F)cc34)c2c1
Show InChI InChI=1S/C17H10F4N2/c18-10-2-12-8(6-22-16(12)14(20)4-10)1-9-7-23-17-13(9)3-11(19)5-15(17)21/h2-7,22-23H,1H2
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n/an/an/an/a 41n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189510
PNG
(CHEMBL3827526)
Show SMILES CCCCCCCCCc1nc(O)cc(O)n1
Show InChI InChI=1S/C13H22N2O2/c1-2-3-4-5-6-7-8-9-11-14-12(16)10-13(17)15-11/h10H,2-9H2,1H3,(H2,14,15,16,17)
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n/an/an/an/a 49n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239194
PNG
(CHEMBL4101728)
Show SMILES Fc1ccc2[nH]cc(Cc3c[nH]c4ccc(F)cc34)c2c1
Show InChI InChI=1S/C17H12F2N2/c18-12-1-3-16-14(6-12)10(8-20-16)5-11-9-21-17-4-2-13(19)7-15(11)17/h1-4,6-9,20-21H,5H2
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n/an/an/an/a 80n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189508
PNG
(CHEMBL3828073)
Show SMILES CCc1ccc(CCc2nc(O)cc(O)n2)cc1
Show InChI InChI=1S/C14H16N2O2/c1-2-10-3-5-11(6-4-10)7-8-12-15-13(17)9-14(18)16-12/h3-6,9H,2,7-8H2,1H3,(H2,15,16,17,18)
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n/an/an/an/a 88n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239191
PNG
(CHEMBL4062512)
Show SMILES Fc1cccc2c(Cc3c[nH]c4c(F)cccc34)c[nH]c12
Show InChI InChI=1S/C17H12F2N2/c18-14-5-1-3-12-10(8-20-16(12)14)7-11-9-21-17-13(11)4-2-6-15(17)19/h1-6,8-9,20-21H,7H2
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n/an/an/an/a 113n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189549
PNG
(CHEMBL3827756)
Show SMILES CCCCCCSc1nc(O)cc(O)n1
Show InChI InChI=1S/C10H16N2O2S/c1-2-3-4-5-6-15-10-11-8(13)7-9(14)12-10/h7H,2-6H2,1H3,(H2,11,12,13,14)
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n/an/an/an/a 139n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189549
PNG
(CHEMBL3827756)
Show SMILES CCCCCCSc1nc(O)cc(O)n1
Show InChI InChI=1S/C10H16N2O2S/c1-2-3-4-5-6-15-10-11-8(13)7-9(14)12-10/h7H,2-6H2,1H3,(H2,11,12,13,14)
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n/an/an/an/a 144n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in in HEK293 cells assessed as inhibition of forskolin-stimulated cAMP accumulation preincubated...


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239171
PNG
(CHEMBL4078546)
Show SMILES Fc1cc2[nH]cc(Cc3c[nH]c4cc(F)c(F)cc34)c2cc1F
Show InChI InChI=1S/C17H10F4N2/c18-12-2-10-8(6-22-16(10)4-14(12)20)1-9-7-23-17-5-15(21)13(19)3-11(9)17/h2-7,22-23H,1H2
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n/an/an/an/a 187n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189553
PNG
(CHEMBL3827763)
Show SMILES CCCCCCCSc1nc(O)cc(O)n1
Show InChI InChI=1S/C11H18N2O2S/c1-2-3-4-5-6-7-16-11-12-9(14)8-10(15)13-11/h8H,2-7H2,1H3,(H2,12,13,14,15)
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n/an/an/an/a 231n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239186
PNG
(1,1-Bis(3''-Indolyl)Methane | 3,3''-Diindolylmetha...)
Show SMILES C(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12
Show InChI InChI=1S/C17H14N2/c1-3-7-16-14(5-1)12(10-18-16)9-13-11-19-17-8-4-2-6-15(13)17/h1-8,10-11,18-19H,9H2
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n/an/an/an/a 252n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239185
PNG
(CHEMBL4075099)
Show SMILES Fc1ccc2[nH]cc(Cc3c[nH]c4ccccc34)c2c1
Show InChI InChI=1S/C17H13FN2/c18-13-5-6-17-15(8-13)12(10-20-17)7-11-9-19-16-4-2-1-3-14(11)16/h1-6,8-10,19-20H,7H2
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n/an/an/an/a 264n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189554
PNG
(CHEMBL3827862)
Show SMILES CCCCCCCCSc1nc(O)cc(O)n1
Show InChI InChI=1S/C12H20N2O2S/c1-2-3-4-5-6-7-8-17-12-13-10(15)9-11(16)14-12/h9H,2-8H2,1H3,(H2,13,14,15,16)
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n/an/an/an/a 264n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189555
PNG
(CHEMBL3827038)
Show SMILES CCc1ccc(CSc2nc(O)cc(O)n2)cc1
Show InChI InChI=1S/C13H14N2O2S/c1-2-9-3-5-10(6-4-9)8-18-13-14-11(16)7-12(17)15-13/h3-7H,2,8H2,1H3,(H2,14,15,16,17)
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n/an/an/an/a 271n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189509
PNG
(CHEMBL3828004)
Show SMILES CCCCCCCC(C)c1nc(O)cc(O)n1
Show InChI InChI=1/C13H22N2O2/c1-3-4-5-6-7-8-10(2)13-14-11(16)9-12(17)15-13/h9-10H,3-8H2,1-2H3,(H2,14,15,16,17)
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n/an/an/an/a 299n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239168
PNG
(CHEMBL4101219)
Show SMILES Fc1cccc2[nH]cc(Cc3c[nH]c4cccc(F)c34)c12
Show InChI InChI=1S/C17H12F2N2/c18-12-3-1-5-14-16(12)10(8-20-14)7-11-9-21-15-6-2-4-13(19)17(11)15/h1-6,8-9,20-21H,7H2
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n/an/an/an/a 328n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239213
PNG
(CHEMBL246298)
Show SMILES COc1ccc2[nH]cc(Cc3c[nH]c4ccc(OC)cc34)c2c1
Show InChI InChI=1S/C19H18N2O2/c1-22-14-3-5-18-16(8-14)12(10-20-18)7-13-11-21-19-6-4-15(23-2)9-17(13)19/h3-6,8-11,20-21H,7H2,1-2H3
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n/an/an/an/a 365n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239170
PNG
(CHEMBL4096571)
Show SMILES Fc1ccc2[nH]cc(Cc3c[nH]c4ccc(F)c(F)c34)c2c1F
Show InChI InChI=1S/C17H10F4N2/c18-10-1-3-12-14(16(10)20)8(6-22-12)5-9-7-23-13-4-2-11(19)17(21)15(9)13/h1-4,6-7,22-23H,5H2
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n/an/an/an/a 377n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50078850
PNG
(CHEBI:4778 | EMBELIN | Embelin)
Show SMILES CCCCCCCCCCCC1=C(O)C(=O)C=C(O)C1=O
Show InChI InChI=1S/C17H26O4/c1-2-3-4-5-6-7-8-9-10-11-13-16(20)14(18)12-15(19)17(13)21/h12,18,21H,2-11H2,1H3
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n/an/an/an/a 400n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at human GPR84 expressed in CHO cells assessed as beta-arrestin recruitment after 90 mins by beta-galactosidase complementation assa...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50078850
PNG
(CHEBI:4778 | EMBELIN | Embelin)
Show SMILES CCCCCCCCCCCC1=C(O)C(=O)C=C(O)C1=O
Show InChI InChI=1S/C17H26O4/c1-2-3-4-5-6-7-8-9-10-11-13-16(20)14(18)12-15(19)17(13)21/h12,18,21H,2-11H2,1H3
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n/an/an/an/a 421n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at human PK-tagged GPR84 expressed in CHOK1 cells assessed as EA-tagged beta-arrestin recruitment by beta-galactosidase complementat...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189527
PNG
(CHEMBL3827310)
Show SMILES Oc1cc(O)nc(SCCCCc2ccccc2)n1
Show InChI InChI=1S/C14H16N2O2S/c17-12-10-13(18)16-14(15-12)19-9-5-4-8-11-6-2-1-3-7-11/h1-3,6-7,10H,4-5,8-9H2,(H2,15,16,17,18)
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n/an/an/an/a 435n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189502
PNG
(CHEMBL3827832)
Show SMILES CCCCCCCCNc1cc(=O)[nH]c(=O)[nH]1
Show InChI InChI=1S/C12H21N3O2/c1-2-3-4-5-6-7-8-13-10-9-11(16)15-12(17)14-10/h9H,2-8H2,1H3,(H3,13,14,15,16,17)
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n/an/an/an/a 438n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189536
PNG
(CHEMBL3827946)
Show SMILES CCCCCCc1nc(O)cc(O)n1
Show InChI InChI=1S/C10H16N2O2/c1-2-3-4-5-6-8-11-9(13)7-10(14)12-8/h7H,2-6H2,1H3,(H2,11,12,13,14)
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n/an/an/an/a 454n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189502
PNG
(CHEMBL3827832)
Show SMILES CCCCCCCCNc1cc(=O)[nH]c(=O)[nH]1
Show InChI InChI=1S/C12H21N3O2/c1-2-3-4-5-6-7-8-13-10-9-11(16)15-12(17)14-10/h9H,2-8H2,1H3,(H3,13,14,15,16,17)
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n/an/an/an/a 512n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at human GPR84 fused with bovine Galphai1 protein expressed in baculovirus infected sf9 cell membrane incubated for 1 hr by [35S]GTP...


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189502
PNG
(CHEMBL3827832)
Show SMILES CCCCCCCCNc1cc(=O)[nH]c(=O)[nH]1
Show InChI InChI=1S/C12H21N3O2/c1-2-3-4-5-6-7-8-13-10-9-11(16)15-12(17)14-10/h9H,2-8H2,1H3,(H3,13,14,15,16,17)
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n/an/an/an/a 512n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at human GPR84 by [35S]GTPgammaS binding assay


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239183
PNG
(CHEMBL4087824)
Show SMILES O=C(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12
Show InChI InChI=1S/C17H12N2O/c20-17(13-9-18-15-7-3-1-5-11(13)15)14-10-19-16-8-4-2-6-12(14)16/h1-10,18-19H
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n/an/an/an/a 553n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189515
PNG
(CHEMBL3828415)
Show SMILES Oc1cc(O)nc(SCCCc2ccccc2)n1
Show InChI InChI=1S/C13H14N2O2S/c16-11-9-12(17)15-13(14-11)18-8-4-7-10-5-2-1-3-6-10/h1-3,5-6,9H,4,7-8H2,(H2,14,15,16,17)
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n/an/an/an/a 573n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239189
PNG
(CHEMBL4082668)
Show SMILES Fc1ccc2c(Cc3c[nH]c4cc(F)ccc34)c[nH]c2c1
Show InChI InChI=1S/C17H12F2N2/c18-12-1-3-14-10(8-20-16(14)6-12)5-11-9-21-17-7-13(19)2-4-15(11)17/h1-4,6-9,20-21H,5H2
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n/an/an/an/a 625n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189551
PNG
(CHEMBL3828230)
Show SMILES CC(C)CCCSc1nc(O)cc(O)n1
Show InChI InChI=1S/C10H16N2O2S/c1-7(2)4-3-5-15-10-11-8(13)6-9(14)12-10/h6-7H,3-5H2,1-2H3,(H2,11,12,13,14)
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n/an/an/an/a 641n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189539
PNG
(CHEMBL3828212)
Show SMILES CCC#CCCSc1nc(O)cc(O)n1
Show InChI InChI=1S/C10H12N2O2S/c1-2-3-4-5-6-15-10-11-8(13)7-9(14)12-10/h7H,2,5-6H2,1H3,(H2,11,12,13,14)
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n/an/an/an/a 653n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189502
PNG
(CHEMBL3827832)
Show SMILES CCCCCCCCNc1cc(=O)[nH]c(=O)[nH]1
Show InChI InChI=1S/C12H21N3O2/c1-2-3-4-5-6-7-8-13-10-9-11(16)15-12(17)14-10/h9H,2-8H2,1H3,(H3,13,14,15,16,17)
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n/an/an/an/a 653n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50078850
PNG
(CHEBI:4778 | EMBELIN | Embelin)
Show SMILES CCCCCCCCCCCC1=C(O)C(=O)C=C(O)C1=O
Show InChI InChI=1S/C17H26O4/c1-2-3-4-5-6-7-8-9-10-11-13-16(20)14(18)12-15(19)17(13)21/h12,18,21H,2-11H2,1H3
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n/an/an/an/a 795n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189506
PNG
(CHEMBL3827933)
Show SMILES CCCCCCCCc1cc(O)nc(O)n1
Show InChI InChI=1S/C12H20N2O2/c1-2-3-4-5-6-7-8-10-9-11(15)14-12(16)13-10/h9H,2-8H2,1H3,(H2,13,14,15,16)
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n/an/an/an/a 811n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189540
PNG
(CHEMBL3828033)
Show SMILES CC\C=C/CCSc1nc(O)cc(O)n1
Show InChI InChI=1S/C10H14N2O2S/c1-2-3-4-5-6-15-10-11-8(13)7-9(14)12-10/h3-4,7H,2,5-6H2,1H3,(H2,11,12,13,14)/b4-3-
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n/an/an/an/a 938n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239192
PNG
(CHEMBL4077871)
Show SMILES Cc1cccc2[nH]cc(Cc3c[nH]c4cccc(C)c34)c12
Show InChI InChI=1S/C19H18N2/c1-12-5-3-7-16-18(12)14(10-20-16)9-15-11-21-17-8-4-6-13(2)19(15)17/h3-8,10-11,20-21H,9H2,1-2H3
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n/an/an/an/a 987n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189528
PNG
(CHEMBL3827935)
Show SMILES Oc1cc(O)nc(SCCCCCc2ccccc2)n1
Show InChI InChI=1S/C15H18N2O2S/c18-13-11-14(19)17-15(16-13)20-10-6-2-5-9-12-7-3-1-4-8-12/h1,3-4,7-8,11H,2,5-6,9-10H2,(H2,16,17,18,19)
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n/an/an/an/a 1.08E+3n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239185
PNG
(CHEMBL4075099)
Show SMILES Fc1ccc2[nH]cc(Cc3c[nH]c4ccccc34)c2c1
Show InChI InChI=1S/C17H13FN2/c18-13-5-6-17-15(8-13)12(10-20-17)7-11-9-19-16-4-2-1-3-14(11)16/h1-6,8-10,19-20H,7H2
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n/an/an/an/a 1.08E+3n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at human GPR84 expressed in CHO cells assessed as beta-arrestin recruitment after 90 mins by beta-galactosidase complementation assa...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239193
PNG
(CHEMBL4066454)
Show SMILES Clc1cccc2[nH]cc(Cc3c[nH]c4cccc(Cl)c34)c12
Show InChI InChI=1S/C17H12Cl2N2/c18-12-3-1-5-14-16(12)10(8-20-14)7-11-9-21-15-6-2-4-13(19)17(11)15/h1-6,8-9,20-21H,7H2
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n/an/an/an/a 1.14E+3n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189547
PNG
(CHEMBL3827684)
Show SMILES CCCCCCCCCCCCSc1nc(O)cc(O)n1
Show InChI InChI=1S/C16H28N2O2S/c1-2-3-4-5-6-7-8-9-10-11-12-21-16-17-14(19)13-15(20)18-16/h13H,2-12H2,1H3,(H2,17,18,19,20)
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n/an/an/an/a 1.16E+3n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239213
PNG
(CHEMBL246298)
Show SMILES COc1ccc2[nH]cc(Cc3c[nH]c4ccc(OC)cc34)c2c1
Show InChI InChI=1S/C19H18N2O2/c1-22-14-3-5-18-16(8-14)12(10-20-18)7-13-11-21-19-6-4-15(23-2)9-17(13)19/h3-6,8-11,20-21H,7H2,1-2H3
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n/an/an/an/a 1.20E+3n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at human GPR84 expressed in CHO cells assessed as beta-arrestin recruitment after 90 mins by beta-galactosidase complementation assa...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239168
PNG
(CHEMBL4101219)
Show SMILES Fc1cccc2[nH]cc(Cc3c[nH]c4cccc(F)c34)c12
Show InChI InChI=1S/C17H12F2N2/c18-12-3-1-5-14-16(12)10(8-20-14)7-11-9-21-15-6-2-4-13(19)17(11)15/h1-6,8-9,20-21H,7H2
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n/an/an/an/a 1.23E+3n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at human GPR84 expressed in CHO cells assessed as beta-arrestin recruitment after 90 mins by beta-galactosidase complementation assa...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239186
PNG
(1,1-Bis(3''-Indolyl)Methane | 3,3''-Diindolylmetha...)
Show SMILES C(c1c[nH]c2ccccc12)c1c[nH]c2ccccc12
Show InChI InChI=1S/C17H14N2/c1-3-7-16-14(5-1)12(10-18-16)9-13-11-19-17-8-4-2-6-15(13)17/h1-8,10-11,18-19H,9H2
UniProtKB/SwissProt

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PC sid
UniChem

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Article
PubMed
n/an/an/an/a 1.64E+3n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at human GPR84 expressed in CHO cells assessed as beta-arrestin recruitment after 90 mins by beta-galactosidase complementation assa...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50239184
PNG
(CHEMBL4095532)
Show SMILES COc1ccc2[nH]cc(Cc3c[nH]c4ccccc34)c2c1
Show InChI InChI=1S/C18H16N2O/c1-21-14-6-7-18-16(9-14)13(11-20-18)8-12-10-19-17-5-3-2-4-15(12)17/h2-7,9-11,19-20H,8H2,1H3
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PC sid
UniChem

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PubMed
n/an/an/an/a 1.89E+3n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Agonist activity at Gi coupled human GPR84 expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation after 15 mins in pres...


J Med Chem 60: 3636-3655 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01593
BindingDB Entry DOI: 10.7270/Q289180W
More data for this
Ligand-Target Pair
G-protein coupled receptor 84


(Homo sapiens (Human))
BDBM50189534
PNG
(CHEMBL3827606)
Show SMILES CC(C)CCCc1nc(O)cc(O)n1
Show InChI InChI=1S/C10H16N2O2/c1-7(2)4-3-5-8-11-9(13)6-10(14)12-8/h6-7H,3-5H2,1-2H3,(H2,11,12,13,14)
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PC sid
UniChem
Article
PubMed
n/an/an/an/a 2.11E+3n/an/an/an/a



East China Normal University

Curated by ChEMBL


Assay Description
Agonist activity at GPR84 (unknown origin) expressed in HEK293 cells coexpressing Galpha16 protein by Fluo-4 AM dye based calcium mobilization assay


ACS Med Chem Lett 7: 579-83 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00025
BindingDB Entry DOI: 10.7270/Q2HH6N11
More data for this
Ligand-Target Pair
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