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Compile Data Set for Download or QSAR

Found 8 hits of ec50 for monomerid = 78304   
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
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM78304
PNG
(2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphe...)
Show SMILES Oc1ccc(CC=C)cc1-c1cc(CC=C)ccc1O
Show InChI InChI=1S/C18H18O2/c1-3-5-13-7-9-17(19)15(11-13)16-12-14(6-4-2)8-10-18(16)20/h3-4,7-12,19-20H,1-2,5-6H2
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n/an/an/an/a 458n/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Peroxisome proliferator-activated receptor gamma


(Homo sapiens (Human))
BDBM78304
PNG
(2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphe...)
Show SMILES Oc1ccc(CC=C)cc1-c1cc(CC=C)ccc1O
Show InChI InChI=1S/C18H18O2/c1-3-5-13-7-9-17(19)15(11-13)16-12-14(6-4-2)8-10-18(16)20/h3-4,7-12,19-20H,1-2,5-6H2
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n/an/an/an/a 1.62E+3n/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM78304
PNG
(2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphe...)
Show SMILES Oc1ccc(CC=C)cc1-c1cc(CC=C)ccc1O
Show InChI InChI=1S/C18H18O2/c1-3-5-13-7-9-17(19)15(11-13)16-12-14(6-4-2)8-10-18(16)20/h3-4,7-12,19-20H,1-2,5-6H2
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Article
PubMed
n/an/an/an/a 3.28E+3n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Partial agonist activity at recombinant human CB2 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation at 10...


ACS Med Chem Lett 4: 41-5 (2013)


Article DOI: 10.1021/ml300235q
BindingDB Entry DOI: 10.7270/Q2SF2XHW
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2/gamma-2


(Homo sapiens (Human))
BDBM78304
PNG
(2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphe...)
Show SMILES Oc1ccc(CC=C)cc1-c1cc(CC=C)ccc1O
Show InChI InChI=1S/C18H18O2/c1-3-5-13-7-9-17(19)15(11-13)16-12-14(6-4-2)8-10-18(16)20/h3-4,7-12,19-20H,1-2,5-6H2
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n/an/an/an/a 4.80E+3n/an/an/an/a


TBA



Citation and Details

Article DOI: 10.1021/acs.jnatprod.1c00840
BindingDB Entry DOI: 10.7270/Q2K64P33
More data for this
Ligand-Target Pair
Peroxisome proliferator-activated receptor delta


(Homo sapiens (Human))
BDBM78304
PNG
(2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphe...)
Show SMILES Oc1ccc(CC=C)cc1-c1cc(CC=C)ccc1O
Show InChI InChI=1S/C18H18O2/c1-3-5-13-7-9-17(19)15(11-13)16-12-14(6-4-2)8-10-18(16)20/h3-4,7-12,19-20H,1-2,5-6H2
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n/an/an/an/a 1.14E+4n/an/an/an/a


TBA



Citation and Details
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM78304
PNG
(2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphe...)
Show SMILES Oc1ccc(CC=C)cc1-c1cc(CC=C)ccc1O
Show InChI InChI=1S/C18H18O2/c1-3-5-13-7-9-17(19)15(11-13)16-12-14(6-4-2)8-10-18(16)20/h3-4,7-12,19-20H,1-2,5-6H2
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n/an/an/an/a 1.83E+4n/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Partial agonist activity at recombinant human CB1 receptor expressed in CHO cells assessed as inhibition of forskolin-induced cAMP accumulation at 10...


ACS Med Chem Lett 4: 41-5 (2013)


Article DOI: 10.1021/ml300235q
BindingDB Entry DOI: 10.7270/Q2SF2XHW
More data for this
Ligand-Target Pair
Gamma-aminobutyric acid receptor subunit alpha-1/beta-2


(Homo sapiens (Human))
BDBM78304
PNG
(2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphe...)
Show SMILES Oc1ccc(CC=C)cc1-c1cc(CC=C)ccc1O
Show InChI InChI=1S/C18H18O2/c1-3-5-13-7-9-17(19)15(11-13)16-12-14(6-4-2)8-10-18(16)20/h3-4,7-12,19-20H,1-2,5-6H2
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Article
PubMed
n/an/an/an/a 3.68E+4n/an/an/an/a



University of Vienna

Curated by ChEMBL


Assay Description
Modulation of GABA Aalpha1beta2 receptor expressed in Xenopus laevis oocytes assessed as potentiation of GABA-induced chloride current at holding pot...


J Med Chem 54: 5349-61 (2011)


Article DOI: 10.1021/jm200186n
BindingDB Entry DOI: 10.7270/Q2QR4XGP
More data for this
Ligand-Target Pair
Aldehyde dehydrogenase, mitochondrial


(Homo sapiens (Human))
BDBM78304
PNG
(2-(2-hydroxy-5-prop-2-enylphenyl)-4-prop-2-enylphe...)
Show SMILES Oc1ccc(CC=C)cc1-c1cc(CC=C)ccc1O
Show InChI InChI=1S/C18H18O2/c1-3-5-13-7-9-17(19)15(11-13)16-12-14(6-4-2)8-10-18(16)20/h3-4,7-12,19-20H,1-2,5-6H2
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n/an/an/an/a 5.79E+4n/an/an/an/a


TBA

Assay Description
Agonist activity at human recombinant ALDH2 measured after 1 hr


Citation and Details

Article DOI: 10.1016/j.bmcl.2021.128045
BindingDB Entry DOI: 10.7270/Q2N301QC
More data for this
Ligand-Target Pair