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BDBM50242286 2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,6-dimethoxy-4H-chromen-4-one::CHEMBL487810::axillarin

SMILES: COc1c(O)cc2oc(-c3ccc(O)c(O)c3)c(OC)c(=O)c2c1O

InChI Key: InChIKey=KIGVXRGRNLQNNI-UHFFFAOYSA-N

Data: 2 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50242286   
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
Aldose reductase


(Rattus norvegicus)
BDBM50242286
PNG
(2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,6-dimethox...)
Show SMILES COc1c(O)cc2oc(-c3ccc(O)c(O)c3)c(OC)c(=O)c2c1O
Show InChI InChI=1S/C17H14O8/c1-23-16-10(20)6-11-12(13(16)21)14(22)17(24-2)15(25-11)7-3-4-8(18)9(19)5-7/h3-6,18-21H,1-2H3
PDB
MMDB

Reactome pathway
KEGG

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

Similars

Article
PubMed
n/an/a 28.0n/an/an/an/an/an/a



INIFTA (UNLP, CCT La Plata-CONICET)

Curated by ChEMBL


Assay Description
Inhibition of rat lens aldose reductase


Bioorg Med Chem 16: 7470-6 (2008)


Article DOI: 10.1016/j.bmc.2008.06.004
BindingDB Entry DOI: 10.7270/Q2862HQJ
More data for this
Ligand-Target Pair
Xanthine dehydrogenase/oxidase


(Homo sapiens (Human))
BDBM50242286
PNG
(2-(3,4-dihydroxyphenyl)-5,7-dihydroxy-3,6-dimethox...)
Show SMILES COc1c(O)cc2oc(-c3ccc(O)c(O)c3)c(OC)c(=O)c2c1O
Show InChI InChI=1S/C17H14O8/c1-23-16-10(20)6-11-12(13(16)21)14(22)17(24-2)15(25-11)7-3-4-8(18)9(19)5-7/h3-6,18-21H,1-2H3
PDB
MMDB

KEGG

B.MOAD
DrugBank
GoogleScholar
AffyNet 
Purchase

CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.60E+4n/an/an/an/an/an/a



Nanjing University

Curated by ChEMBL


Assay Description
Inhibition of xanthine oxidase (unknown origin) by spectrophotometry


J Nat Prod 62: 1053-5 (1999)


Article DOI: 10.1021/np990009i
BindingDB Entry DOI: 10.7270/Q2MP531P
More data for this
Ligand-Target Pair