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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Polyphenol oxidase 2' and Ligand = 'BDBM50421153'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Polyphenol oxidase 2


(Agaricus bisporus (Common mushroom))
BDBM50421153
PNG
(CHEMBL2088604)
Show SMILES Cn1c2ccccc2c2cc(\C=C\C(=O)c3cccc(NC(=O)c4cccc(c4)C(F)(F)F)c3)ccc12
Show InChI InChI=1S/C30H21F3N2O2/c1-35-26-11-3-2-10-24(26)25-16-19(12-14-27(25)35)13-15-28(36)20-6-5-9-23(18-20)34-29(37)21-7-4-8-22(17-21)30(31,32)33/h2-18H,1H3,(H,34,37)/b15-13+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 6.52E+4n/an/an/an/an/an/a



Solapur University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase using L-tyrosine as substrate after 5 mins by UV-spectrophotometric analysis


Bioorg Med Chem 20: 5649-57 (2012)


Article DOI: 10.1016/j.bmc.2012.07.001
BindingDB Entry DOI: 10.7270/Q24X5934
More data for this
Ligand-Target Pair
Polyphenol oxidase 2


(Agaricus bisporus (Common mushroom))
BDBM50421153
PNG
(CHEMBL2088604)
Show SMILES Cn1c2ccccc2c2cc(\C=C\C(=O)c3cccc(NC(=O)c4cccc(c4)C(F)(F)F)c3)ccc12
Show InChI InChI=1S/C30H21F3N2O2/c1-35-26-11-3-2-10-24(26)25-16-19(12-14-27(25)35)13-15-28(36)20-6-5-9-23(18-20)34-29(37)21-7-4-8-22(17-21)30(31,32)33/h2-18H,1H3,(H,34,37)/b15-13+
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.50E+4n/an/an/an/an/an/a



Solapur University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase using L-DOPA as substrate after 5 mins by UV-spectrophotometric analysis


Bioorg Med Chem 20: 5649-57 (2012)


Article DOI: 10.1016/j.bmc.2012.07.001
BindingDB Entry DOI: 10.7270/Q24X5934
More data for this
Ligand-Target Pair