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BDBM153281 1-Benzofuran-2-yl-3-(4,7-dimethoxy-naphthalen-1-yl)-propenone (2)

SMILES: COc1ccc2c(OC)ccc(\C=C\C(=O)c3cc4ccccc4o3)c2c1

InChI Key: InChIKey=ZZNLOWNLKLCDFQ-YRNVUSSQSA-N

Data: 3 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 3 hits for monomerid = 153281   
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
Secretory phospholipase A2, group V (sPLA2-V)


(Homo sapiens (Human))
BDBM153281
PNG
(1-Benzofuran-2-yl-3-(4,7-dimethoxy-naphthalen-1-yl...)
Show SMILES COc1ccc2c(OC)ccc(\C=C\C(=O)c3cc4ccccc4o3)c2c1
Show InChI InChI=1S/C23H18O4/c1-25-17-9-10-18-19(14-17)15(8-12-22(18)26-2)7-11-20(24)23-13-16-5-3-4-6-21(16)27-23/h3-14H,1-2H3/b11-7+
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.78E+4n/an/an/an/a7.525



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz



Assay Description
Briefly, sn-2ester bond of the substrate 1,2-bis(heptanoylthio)-glycerophosphocholine was hydrolyzed by PLA2-V followed by the exposure of free thiol...


Chem Biol Drug Des 85: 729-42 (2015)


Article DOI: 10.1111/cbdd.12457
BindingDB Entry DOI: 10.7270/Q26W98TX
More data for this
Ligand-Target Pair
Cyclooxygenase


(Homo sapiens (Human))
BDBM153281
PNG
(1-Benzofuran-2-yl-3-(4,7-dimethoxy-naphthalen-1-yl...)
Show SMILES COc1ccc2c(OC)ccc(\C=C\C(=O)c3cc4ccccc4o3)c2c1
Show InChI InChI=1S/C23H18O4/c1-25-17-9-10-18-19(14-17)15(8-12-22(18)26-2)7-11-20(24)23-13-16-5-3-4-6-21(16)27-23/h3-14H,1-2H3/b11-7+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.91E+4n/an/an/an/a8.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz



Assay Description
100 mM TrisHCl buffer, pH 8.0 containing 1 M heme and COX-1 (ovine) or COX-2(human recombinant), which was preincubated for 10 min in a water bath ...


Chem Biol Drug Des 85: 729-42 (2015)


Article DOI: 10.1111/cbdd.12457
BindingDB Entry DOI: 10.7270/Q26W98TX
More data for this
Ligand-Target Pair
Prostaglandin G/H synthase (cyclooxygenase)


(Ovis aries (Sheep))
BDBM153281
PNG
(1-Benzofuran-2-yl-3-(4,7-dimethoxy-naphthalen-1-yl...)
Show SMILES COc1ccc2c(OC)ccc(\C=C\C(=O)c3cc4ccccc4o3)c2c1
Show InChI InChI=1S/C23H18O4/c1-25-17-9-10-18-19(14-17)15(8-12-22(18)26-2)7-11-20(24)23-13-16-5-3-4-6-21(16)27-23/h3-14H,1-2H3/b11-7+
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.50E+4n/an/an/an/a8.025



Universiti Kebangsaan Malaysia, Jalan Raja Muda Abdul Aziz



Assay Description
100 mM TrisHCl buffer, pH 8.0 containing 1 M heme and COX-1 (ovine) or COX-2(human recombinant), which was preincubated for 10 min in a water bath ...


Chem Biol Drug Des 85: 729-42 (2015)


Article DOI: 10.1111/cbdd.12457
BindingDB Entry DOI: 10.7270/Q26W98TX
More data for this
Ligand-Target Pair