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BDBM243072 Anisic acid

SMILES: COc1ccc(cc1)C(O)=O

InChI Key: InChIKey=ZEYHEAKUIGZSGI-UHFFFAOYSA-N

Data: 4 IC50

PDB links: 13 PDB IDs match this monomer.

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 = 243072   
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
Alpha-glucosidase MAL12


(Saccharomyces cerevisiae)
BDBM243072
PNG
(Anisic acid)
Show SMILES COc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C8H8O3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10)
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KEGG

UniProtKB/SwissProt

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DrugBank
MCE
KEGG
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a>3.00E+5n/an/an/an/a7.025



Kinki University



Assay Description
α-glucosidase (25 μL, 0.2 U/mL), 25 μL of various concentrations of samples, and 175 μL of 50 mM sodium phosphate buffer (pH 7.0)...


J Enzyme Inhib Med Chem 28: 1162-70 (2013)


Article DOI: 10.3109/14756366.2012.719503
BindingDB Entry DOI: 10.7270/Q22F7MCR
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM243072
PNG
(Anisic acid)
Show SMILES COc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C8H8O3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10)
UniProtKB/SwissProt

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DrugBank
MCE
KEGG
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a 4.20E+5n/an/an/an/an/an/a



Hinoki Shinyaku Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase using L-tyrosine as substrate assessed as dopachrome formation preincubated for 10 mins followed by protein additio...


Bioorg Med Chem 24: 4509-4515 (2016)


Article DOI: 10.1016/j.bmc.2016.07.060
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM243072
PNG
(Anisic acid)
Show SMILES COc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C8H8O3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

DrugBank
MCE
KEGG
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a 4.20E+5n/an/an/an/an/an/a



Hinoki Shinyaku Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase using L-tyrosine as substrate assessed as dopachrome formation preincubated for 10 mins followed by protein additio...


Bioorg Med Chem 24: 4509-4515 (2016)


Article DOI: 10.1016/j.bmc.2016.07.060
More data for this
Ligand-Target Pair
Tyrosinase


(Agaricus bisporus (Common mushroom))
BDBM243072
PNG
(Anisic acid)
Show SMILES COc1ccc(cc1)C(O)=O
Show InChI InChI=1S/C8H8O3/c1-11-7-4-2-6(3-5-7)8(9)10/h2-5H,1H3,(H,9,10)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

DrugBank
MCE
KEGG
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



Kinki University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase using L-tyrosine as substrate preincubated for 10 mins followed by enzyme addition measured after 20 mins by microp...


Bioorg Med Chem Lett 23: 6580-4 (2013)


Article DOI: 10.1016/j.bmcl.2013.10.066
BindingDB Entry DOI: 10.7270/Q2QZ2DW5
More data for this
Ligand-Target Pair