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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Polyphenol oxidase 2' and Ligand = 'BDBM50452917'   
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))
BDBM50452917
PNG
(CHEMBL4212198)
Show SMILES CC(C)C(=O)N1CCC(Cc2ccc(F)cc2)CC1
Show InChI InChI=1S/C16H22FNO/c1-12(2)16(19)18-9-7-14(8-10-18)11-13-3-5-15(17)6-4-13/h3-6,12,14H,7-11H2,1-2H3
UniProtKB/SwissProt

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.53E+4n/an/an/an/an/an/a



Universit� di Messina

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase diphenolase activity using L-DOPA as substrate preincubated with substrate for 10 mins followed by protein addition...


J Med Chem 61: 3908-3917 (2018)


Article DOI: 10.1021/acs.jmedchem.7b01745
BindingDB Entry DOI: 10.7270/Q2V127DR
More data for this
Ligand-Target Pair