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BDBM50241379 (enoximone)4-Methyl-5-(4-methylsulfanyl-benzoyl)-1,3-dihydro-imidazol-2-one::4-Methyl-5-(4-methylsulfanyl-benzoyl)-1,3-dihydro-imidazol-2-one::4-Methyl-5-(4-methylsulfanyl-benzoyl)-1,3-dihydro-imidazol-2-one (Enoximone)::4-Methyl-5-(4-methylsulfanyl-benzoyl)-1,3-dihydro-imidazol-2-one(Enoximone)::4-Methyl-5-(4-methylsulfanyl-benzoyl)-1,3-dihydro-imidazol-2-one(fenoximone, MDL-17043)::5-methyl-4-(4-(methylthio)benzoyl)-1H-imidazol-2(3H)-one::CHEMBL249856::FENOXIMONE::MDL-17043

SMILES: CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C

InChI Key: InChIKey=ZJKNESGOIKRXQY-UHFFFAOYSA-N

Data: 13 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 13 hits for monomerid = 50241379   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Homo sapiens phosphodiesterase 2A (PDE2A)


(Homo sapiens (Human))
BDBM50241379
PNG
((enoximone)4-Methyl-5-(4-methylsulfanyl-benzoyl)-1...)
Show SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
Show InChI InChI=1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
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n/an/a 5.20E+5n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of cyclic GMP sensitive phosphodiesterase PDE 2 of guinea pig ventricle


J Med Chem 28: 537-45 (1985)


Article DOI: 10.1021/jm50001a001
BindingDB Entry DOI: 10.7270/Q2N58MXT
More data for this
Ligand-Target Pair
Phosphodiesterase 4


(Homo sapiens (Human))
BDBM50241379
PNG
((enoximone)4-Methyl-5-(4-methylsulfanyl-benzoyl)-1...)
Show SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
Show InChI InChI=1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
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n/an/a 2.90E+3n/an/an/an/an/an/a



Merrell Dow Research Institute

Curated by ChEMBL


Assay Description
Inhibition of canine heart Phosphodiesterase 4


J Med Chem 33: 317-27 (1990)


Article DOI: 10.1021/jm00163a052
BindingDB Entry DOI: 10.7270/Q27S7R0G
More data for this
Ligand-Target Pair
Phosphodiesterase 4


(Homo sapiens (Human))
BDBM50241379
PNG
((enoximone)4-Methyl-5-(4-methylsulfanyl-benzoyl)-1...)
Show SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
Show InChI InChI=1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
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n/an/a>1.50E+5n/an/an/an/an/an/a



Merrell Dow Research Institute

Curated by ChEMBL


Assay Description
Inhibition of canine kidney Phosphodiesterase 4


J Med Chem 33: 317-27 (1990)


Article DOI: 10.1021/jm00163a052
BindingDB Entry DOI: 10.7270/Q27S7R0G
More data for this
Ligand-Target Pair
Phosphodiesterase 3


(Homo sapiens (Human))
BDBM50241379
PNG
((enoximone)4-Methyl-5-(4-methylsulfanyl-benzoyl)-1...)
Show SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
Show InChI InChI=1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
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n/an/a 1.40E+4n/an/an/an/an/an/a



Warner-Lambert Company

Curated by ChEMBL


Assay Description
Inhibition of cAMP PDE III enzyme


J Med Chem 30: 1963-72 (1987)


Article DOI: 10.1021/jm00394a006
BindingDB Entry DOI: 10.7270/Q28K79P9
More data for this
Ligand-Target Pair
Phosphodiesterase 3


(Homo sapiens (Human))
BDBM50241379
PNG
((enoximone)4-Methyl-5-(4-methylsulfanyl-benzoyl)-1...)
Show SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
Show InChI InChI=1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
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n/an/a 1.40E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of low Km cyclic cAMP phosphodiesterase PDE III of guinea pig ventricle


J Med Chem 28: 537-45 (1985)


Article DOI: 10.1021/jm50001a001
BindingDB Entry DOI: 10.7270/Q2N58MXT
More data for this
Ligand-Target Pair
Phosphodiesterase 1


(Homo sapiens (Human))
BDBM50241379
PNG
((enoximone)4-Methyl-5-(4-methylsulfanyl-benzoyl)-1...)
Show SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
Show InChI InChI=1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
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n/an/a>1.00E+6n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [Ca(2+)]/calmodulin dependent phosphodiesterase PDE 1 of guinea pig ventricle


J Med Chem 28: 537-45 (1985)


Article DOI: 10.1021/jm50001a001
BindingDB Entry DOI: 10.7270/Q2N58MXT
More data for this
Ligand-Target Pair
Canalicular multispecific organic anion transporter 1


(Homo sapiens (Human))
BDBM50241379
PNG
((enoximone)4-Methyl-5-(4-methylsulfanyl-benzoyl)-1...)
Show SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
Show InChI InChI=1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
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n/an/a 1.33E+5n/an/an/an/an/an/a



Amgen Inc

Curated by ChEMBL


Assay Description
Inhibition of human MRP2 overexpressed in Sf9 cell membrane vesicles assessed as uptake of [3H]-estradiol-17beta-D-glucuronide in presence of ATP and...


Toxicol Sci 136: 216-41 (2013)


Article DOI: 10.1093/toxsci/kft176
BindingDB Entry DOI: 10.7270/Q2JM2D2D
More data for this
Ligand-Target Pair
Phosphodiesterase 4


(Homo sapiens (Human))
BDBM50241379
PNG
((enoximone)4-Methyl-5-(4-methylsulfanyl-benzoyl)-1...)
Show SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
Show InChI InChI=1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
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n/an/a 5.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of canine cardiac cAMP phosphodiesterase (cAMP-PDE)


J Med Chem 30: 1342-7 (1987)


Article DOI: 10.1021/jm00391a013
BindingDB Entry DOI: 10.7270/Q2DV1N40
More data for this
Ligand-Target Pair
Phosphodiesterase 3


(Homo sapiens (Human))
BDBM50241379
PNG
((enoximone)4-Methyl-5-(4-methylsulfanyl-benzoyl)-1...)
Show SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
Show InChI InChI=1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
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n/an/a 1.40E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of fraction III of guinea pig phosphodiesterase


J Med Chem 27: 1099-101 (1984)


Article DOI: 10.1021/jm00375a001
BindingDB Entry DOI: 10.7270/Q26Q1W70
More data for this
Ligand-Target Pair
Bile salt export pump


(Homo sapiens (Human))
BDBM50241379
PNG
((enoximone)4-Methyl-5-(4-methylsulfanyl-benzoyl)-1...)
Show SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
Show InChI InChI=1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
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n/an/a 1.33E+5n/an/an/an/an/an/a



Amgen Inc

Curated by ChEMBL


Assay Description
Inhibition of human BSEP overexpressed in Sf9 cell membrane vesicles assessed as uptake of [3H]-taurocholate in presence of ATP measured after 15 to ...


Toxicol Sci 136: 216-41 (2013)


Article DOI: 10.1093/toxsci/kft176
BindingDB Entry DOI: 10.7270/Q2JM2D2D
More data for this
Ligand-Target Pair
Multidrug resistance-associated protein 4


(Homo sapiens (Human))
BDBM50241379
PNG
((enoximone)4-Methyl-5-(4-methylsulfanyl-benzoyl)-1...)
Show SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
Show InChI InChI=1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
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n/an/a 1.33E+5n/an/an/an/an/an/a



Amgen Inc

Curated by ChEMBL


Assay Description
Inhibition of human MRP4 overexpressed in Sf9 cell membrane vesicles assessed as uptake of [3H]-estradiol-17beta-D-glucuronide in presence of ATP and...


Toxicol Sci 136: 216-41 (2013)


Article DOI: 10.1093/toxsci/kft176
BindingDB Entry DOI: 10.7270/Q2JM2D2D
More data for this
Ligand-Target Pair
Canalicular multispecific organic anion transporter 2


(Homo sapiens (Human))
BDBM50241379
PNG
((enoximone)4-Methyl-5-(4-methylsulfanyl-benzoyl)-1...)
Show SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
Show InChI InChI=1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
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n/an/a 1.33E+5n/an/an/an/an/an/a



Amgen Inc

Curated by ChEMBL


Assay Description
Inhibition of human MRP3 overexpressed in Sf9 insect cell membrane vesicles assessed as uptake of [3H]-estradiol-17beta-D-glucuronide in presence of ...


Toxicol Sci 136: 216-41 (2013)


Article DOI: 10.1093/toxsci/kft176
BindingDB Entry DOI: 10.7270/Q2JM2D2D
More data for this
Ligand-Target Pair
Phosphodiesterase 3


(Homo sapiens (Human))
BDBM50241379
PNG
((enoximone)4-Methyl-5-(4-methylsulfanyl-benzoyl)-1...)
Show SMILES CSc1ccc(cc1)C(=O)c1[nH]c(=O)[nH]c1C
Show InChI InChI=1S/C12H12N2O2S/c1-7-10(14-12(16)13-7)11(15)8-3-5-9(17-2)6-4-8/h3-6H,1-2H3,(H2,13,14,16)
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n/an/a 3.80E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity against sigma receptor


J Med Chem 30: 303-18 (1987)


Article DOI: 10.1021/jm00385a012
BindingDB Entry DOI: 10.7270/Q27946X0
More data for this
Ligand-Target Pair