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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kallikrein-6' and Ligand = 'BDBM50459547'   
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
Kallikrein-6


(Homo sapiens (Human))		BDBM50459547
PNG
(CHEMBL4205435)
Show SMILES Cc1nn(c(C)c1NC(=O)COC(=O)Cc1c[nH]c2ccccc12)-c1ccccc1
Show InChI InChI=1S/C23H22N4O3/c1-15-23(16(2)27(26-15)18-8-4-3-5-9-18)25-21(28)14-30-22(29)12-17-13-24-20-11-7-6-10-19(17)20/h3-11,13,24H,12,14H2,1-2H3,(H,25,28)
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KEGG

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.50E+4n/an/an/an/an/an/a



German Cancer Research Center (DKFZ)

Curated by ChEMBL


Assay Description
Inhibition of His-6-tagged human KLK6 R74G/R76Q/N132Q mutant expressed in Escherichia coli DH10 pre-incubated for 30 mins before N-Boc-FSR-AMC substr...

J Med Chem 61: 8859-8874 (2018)


Article DOI: 10.1021/acs.jmedchem.8b01106
BindingDB Entry DOI: 10.7270/Q279479B
More data for this
Ligand-Target Pair