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BDBM50332182 4,3',5'-tri-O-methylpiceatannol::5-(2-(3,5-Dimethoxyphenyl)vinyl)-2-methoxyphenol::5-[(E)-2-(3,5-Dimethoxy-phenyl)-vinyl]-2-methoxy-phenol::5-[2-(3,5-Dimethoxy-phenyl)-vinyl]-2-methoxy-phenol::CHEMBL419378::NSC-381864

SMILES: COc1cc(OC)cc(\C=C\c2ccc(OC)c(O)c2)c1

InChI Key: InChIKey=UQIWTPQGJCCTPA-SNAWJCMRSA-N

Data: 4 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 4 hits for monomerid = 50332182   
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
Ribosyldihydronicotinamide dehydrogenase [quinone]


(Homo sapiens (Human))
BDBM50332182
PNG
(4,3',5'-tri-O-methylpiceatannol | 5-(2-(3,5-Dimeth...)
Show SMILES COc1cc(OC)cc(\C=C\c2ccc(OC)c(O)c2)c1
Show InChI InChI=1S/C17H18O4/c1-19-14-8-13(9-15(11-14)20-2)5-4-12-6-7-17(21-3)16(18)10-12/h4-11,18H,1-3H3/b5-4+
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CHEMBL
PC cid
PC sid
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Article
PubMed
n/an/a 1.50E+4n/an/an/an/an/an/a



University of Manchester and Manchester Cancer Research Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant NQO2


Bioorg Med Chem Lett 20: 7331-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.070
BindingDB Entry DOI: 10.7270/Q2M32W16
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (Human))
BDBM50332182
PNG
(4,3',5'-tri-O-methylpiceatannol | 5-(2-(3,5-Dimeth...)
Show SMILES COc1cc(OC)cc(\C=C\c2ccc(OC)c(O)c2)c1
Show InChI InChI=1S/C17H18O4/c1-19-14-8-13(9-15(11-14)20-2)5-4-12-6-7-17(21-3)16(18)10-12/h4-11,18H,1-3H3/b5-4+
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Article
PubMed
n/an/a 5.48E+3n/an/an/an/an/an/a



University of Campania "L. Vanvitelli"

Curated by ChEMBL


Assay Description
Inhibition of 5-LOX in human PMNL cells assessed as A23187-stimulated LTB4 production preincubated for 15 mins followed by A23187 addition and measur...


Eur J Med Chem 180: 637-647 (2019)


Article DOI: 10.1016/j.ejmech.2019.07.033
More data for this
Ligand-Target Pair
5-lipoxygenase/FLAP


(Homo sapiens (Human))
BDBM50332182
PNG
(4,3',5'-tri-O-methylpiceatannol | 5-(2-(3,5-Dimeth...)
Show SMILES COc1cc(OC)cc(\C=C\c2ccc(OC)c(O)c2)c1
Show InChI InChI=1S/C17H18O4/c1-19-14-8-13(9-15(11-14)20-2)5-4-12-6-7-17(21-3)16(18)10-12/h4-11,18H,1-3H3/b5-4+
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Article
PubMed
n/an/a 5.49E+3n/an/an/an/an/an/a



University of Campania "L. Vanvitelli"

Curated by ChEMBL


Assay Description
Inhibition of human 5-LOX expressed in Escherichia coli BL21 using arachidonic acid as substrate preincubated for 15 mins followed by substrate addit...


Eur J Med Chem 180: 637-647 (2019)


Article DOI: 10.1016/j.ejmech.2019.07.033
More data for this
Ligand-Target Pair
NAD(P)H dehydrogenase [quinone] 1


(Homo sapiens (Human))
BDBM50332182
PNG
(4,3',5'-tri-O-methylpiceatannol | 5-(2-(3,5-Dimeth...)
Show SMILES COc1cc(OC)cc(\C=C\c2ccc(OC)c(O)c2)c1
Show InChI InChI=1S/C17H18O4/c1-19-14-8-13(9-15(11-14)20-2)5-4-12-6-7-17(21-3)16(18)10-12/h4-11,18H,1-3H3/b5-4+
PDB
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CHEMBL
PC cid
PC sid
UniChem

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Article
PubMed
n/an/a 8.00E+4n/an/an/an/an/an/a



University of Manchester and Manchester Cancer Research Center

Curated by ChEMBL


Assay Description
Inhibition of human recombinant NQO1


Bioorg Med Chem Lett 20: 7331-6 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.070
BindingDB Entry DOI: 10.7270/Q2M32W16
More data for this
Ligand-Target Pair