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SMILES: COc1c(NCCNc2ccnc3cc(Cl)ccc23)c(=O)c1=O

InChI Key: InChIKey=UTXZZLPOEIOQLQ-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50441684   
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
Papain


(Carica papaya)		BDBM50441684
PNG
(CHEMBL2435694)
Show SMILES COc1c(NCCNc2ccnc3cc(Cl)ccc23)c(=O)c1=O
Show InChI InChI=1S/C16H14ClN3O3/c1-23-16-13(14(21)15(16)22)20-7-6-19-11-4-5-18-12-8-9(17)2-3-10(11)12/h2-5,8,20H,6-7H2,1H3,(H,18,19)
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Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



University of Lisbon. Av. Prof. Gama Pinto

Curated by ChEMBL


Assay Description
Inhibition of papaya papain using Z-Leu-Leu-Arg-AMC as substrate after 30 mins by fluorescence microplate reader analysis

Eur J Med Chem 69: 365-72 (2013)


Article DOI: 10.1016/j.ejmech.2013.08.037
BindingDB Entry DOI: 10.7270/Q2CN75BS
More data for this
Ligand-Target Pair