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BDBM50222294 6,7-dihydroxy-3',4'-methylenedioxyisoflavone::CHEMBL239030

SMILES: Oc1cc2occ(-c3ccc4OCOc4c3)c(=O)c2cc1O

InChI Key: InChIKey=NHPSEEFMOLEZQR-UHFFFAOYSA-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 = 50222294   
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
15-Lipoxygenase-2 (15-LOX-2)


(Homo sapiens (Human))
BDBM50222294
PNG
(6,7-dihydroxy-3',4'-methylenedioxyisoflavone | CHE...)
Show SMILES Oc1cc2occ(-c3ccc4OCOc4c3)c(=O)c2cc1O
Show InChI InChI=1S/C16H10O6/c17-11-4-9-14(5-12(11)18)20-6-10(16(9)19)8-1-2-13-15(3-8)22-7-21-13/h1-6,17-18H,7H2
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Universidad de Santiago de Chile

Curated by ChEMBL


Assay Description
Inhibition of 15-hLO2


Bioorg Med Chem 15: 7408-25 (2007)


Article DOI: 10.1016/j.bmc.2007.07.036
BindingDB Entry DOI: 10.7270/Q2RN37KN
More data for this
Ligand-Target Pair
Arachidonate 15-lipoxygenase


(Homo sapiens (Human))
BDBM50222294
PNG
(6,7-dihydroxy-3',4'-methylenedioxyisoflavone | CHE...)
Show SMILES Oc1cc2occ(-c3ccc4OCOc4c3)c(=O)c2cc1O
Show InChI InChI=1S/C16H10O6/c17-11-4-9-14(5-12(11)18)20-6-10(16(9)19)8-1-2-13-15(3-8)22-7-21-13/h1-6,17-18H,7H2
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Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Universidad de Santiago de Chile

Curated by ChEMBL


Assay Description
Inhibition of 15-hLO1


Bioorg Med Chem 15: 7408-25 (2007)


Article DOI: 10.1016/j.bmc.2007.07.036
BindingDB Entry DOI: 10.7270/Q2RN37KN
More data for this
Ligand-Target Pair
12-Lipoxygenase (12-LOX)


(Homo sapiens (Human))
BDBM50222294
PNG
(6,7-dihydroxy-3',4'-methylenedioxyisoflavone | CHE...)
Show SMILES Oc1cc2occ(-c3ccc4OCOc4c3)c(=O)c2cc1O
Show InChI InChI=1S/C16H10O6/c17-11-4-9-14(5-12(11)18)20-6-10(16(9)19)8-1-2-13-15(3-8)22-7-21-13/h1-6,17-18H,7H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Universidad de Santiago de Chile

Curated by ChEMBL


Assay Description
Inhibition of 12-hLO


Bioorg Med Chem 15: 7408-25 (2007)


Article DOI: 10.1016/j.bmc.2007.07.036
BindingDB Entry DOI: 10.7270/Q2RN37KN
More data for this
Ligand-Target Pair