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BDBM50341258 (Z)-5-(4-Methoxybenzylidene)-2-(p-tolyl)-5H-thiazol-4-one::CHEMBL1765888

SMILES: COc1ccc(\C=C2/SC(=NC2=O)c2ccc(C)cc2)cc1

InChI Key: InChIKey=MPJWONVAQZMDCG-WJDWOHSUSA-N

Data: 6 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 6 hits for monomerid = 50341258   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Arachidonate 5-lipoxygenase


(Homo sapiens (Human))
BDBM50341258
PNG
((Z)-5-(4-Methoxybenzylidene)-2-(p-tolyl)-5H-thiazo...)
Show SMILES COc1ccc(\C=C2/SC(=NC2=O)c2ccc(C)cc2)cc1 |c:9|
Show InChI InChI=1S/C18H15NO2S/c1-12-3-7-14(8-4-12)18-19-17(20)16(22-18)11-13-5-9-15(21-2)10-6-13/h3-11H,1-2H3/b16-11-
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n/an/a 300n/an/an/an/an/an/a



Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-LO in human PMNL S100 extract using arachidonic acid as substrate incubated for 15 mins prior to substrate addition measured after 10...


Eur J Med Chem 89: 503-23 (2014)


Article DOI: 10.1016/j.ejmech.2014.10.054
BindingDB Entry DOI: 10.7270/Q2959K5T
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Homo sapiens (Human))
BDBM50341258
PNG
((Z)-5-(4-Methoxybenzylidene)-2-(p-tolyl)-5H-thiazo...)
Show SMILES COc1ccc(\C=C2/SC(=NC2=O)c2ccc(C)cc2)cc1 |c:9|
Show InChI InChI=1S/C18H15NO2S/c1-12-3-7-14(8-4-12)18-19-17(20)16(22-18)11-13-5-9-15(21-2)10-6-13/h3-11H,1-2H3/b16-11-
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n/an/a 660n/an/an/an/an/an/a



Goethe-University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-LO in human PMNL using arachidonic acid as substrate assessed as product formation incubated for 15 mins prior to substrate addition ...


Eur J Med Chem 89: 503-23 (2014)


Article DOI: 10.1016/j.ejmech.2014.10.054
BindingDB Entry DOI: 10.7270/Q2959K5T
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Homo sapiens (Human))
BDBM50341258
PNG
((Z)-5-(4-Methoxybenzylidene)-2-(p-tolyl)-5H-thiazo...)
Show SMILES COc1ccc(\C=C2/SC(=NC2=O)c2ccc(C)cc2)cc1 |c:9|
Show InChI InChI=1S/C18H15NO2S/c1-12-3-7-14(8-4-12)18-19-17(20)16(22-18)11-13-5-9-15(21-2)10-6-13/h3-11H,1-2H3/b16-11-
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Article
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n/an/a 300n/an/an/an/an/an/a



Goethe University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 supernatant assessed as inhibition of (5(S)-hydroperoxy-6-trans-8,11,14-cis-eicosatetraenoic acid production pre...


J Med Chem 54: 1943-7 (2011)

Checked by Author
Article DOI: 10.1021/jm101165z
BindingDB Entry DOI: 10.7270/Q23T9J70
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Homo sapiens (Human))
BDBM50341258
PNG
((Z)-5-(4-Methoxybenzylidene)-2-(p-tolyl)-5H-thiazo...)
Show SMILES COc1ccc(\C=C2/SC(=NC2=O)c2ccc(C)cc2)cc1 |c:9|
Show InChI InChI=1S/C18H15NO2S/c1-12-3-7-14(8-4-12)18-19-17(20)16(22-18)11-13-5-9-15(21-2)10-6-13/h3-11H,1-2H3/b16-11-
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PubMed
n/an/a 660n/an/an/an/an/an/a



Goethe University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as inhibition of (5(S)-hydroperoxy-6-trans-8,11,14-cis-eicosatetraenoic a...


J Med Chem 54: 1943-7 (2011)

Checked by Author
Article DOI: 10.1021/jm101165z
BindingDB Entry DOI: 10.7270/Q23T9J70
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Homo sapiens (Human))
BDBM50341258
PNG
((Z)-5-(4-Methoxybenzylidene)-2-(p-tolyl)-5H-thiazo...)
Show SMILES COc1ccc(\C=C2/SC(=NC2=O)c2ccc(C)cc2)cc1 |c:9|
Show InChI InChI=1S/C18H15NO2S/c1-12-3-7-14(8-4-12)18-19-17(20)16(22-18)11-13-5-9-15(21-2)10-6-13/h3-11H,1-2H3/b16-11-
PDB
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PC sid
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Article
PubMed
n/an/a 300n/an/an/an/an/an/a



Goethe University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in S100 supernatant assessed as inhibition of LTB4 production preincubated for 15 mins measured after 10 mins by HPLC me...


J Med Chem 54: 1943-7 (2011)

Checked by Author
Article DOI: 10.1021/jm101165z
BindingDB Entry DOI: 10.7270/Q23T9J70
More data for this
Ligand-Target Pair
Arachidonate 5-lipoxygenase


(Homo sapiens (Human))
BDBM50341258
PNG
((Z)-5-(4-Methoxybenzylidene)-2-(p-tolyl)-5H-thiazo...)
Show SMILES COc1ccc(\C=C2/SC(=NC2=O)c2ccc(C)cc2)cc1 |c:9|
Show InChI InChI=1S/C18H15NO2S/c1-12-3-7-14(8-4-12)18-19-17(20)16(22-18)11-13-5-9-15(21-2)10-6-13/h3-11H,1-2H3/b16-11-
PDB
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 660n/an/an/an/an/an/a



Goethe University Frankfurt

Curated by ChEMBL


Assay Description
Inhibition of 5-lipoxygenase in human polymorphonuclear leukocytes assessed as inhibition of LTB4 production preincubated for 15 mins measured after ...


J Med Chem 54: 1943-7 (2011)

Checked by Author
Article DOI: 10.1021/jm101165z
BindingDB Entry DOI: 10.7270/Q23T9J70
More data for this
Ligand-Target Pair