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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 = 'BDBM50321283'   
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))		BDBM50321283
PNG
(Alpneumine E | CHEMBL1163800)
Show SMILES COC(=O)C1[C@@H]2C[C@H]3N(CC[C@@]33C1=Nc1ccccc31)C[C@H]2C(C)=O |r,t:14|
Show InChI InChI=1S/C20H22N2O3/c1-11(23)13-10-22-8-7-20-14-5-3-4-6-15(14)21-18(20)17(19(24)25-2)12(13)9-16(20)22/h3-6,12-13,16-17H,7-10H2,1-2H3/t12?,13-,16+,17?,20-/m0/s1
UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

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



Hoshi University

Curated by ChEMBL


Assay Description
Inhibition of mushroom tyrosinase

Bioorg Med Chem 18: 4415-21 (2010)


Article DOI: 10.1016/j.bmc.2010.04.086
BindingDB Entry DOI: 10.7270/Q2ZC831T
More data for this
Ligand-Target Pair