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SMILES: NC(=N)c1ccc2[nH]c(cc2c1)-c1cc(ccc1O)-c1ccc(F)cc1

InChI Key: InChIKey=HLEBMKHWFJIKMB-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50187711   
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
Serine protease hepsin


(Homo sapiens (Human))		BDBM50187711
PNG
(CHEMBL3827463)
Show SMILES NC(=N)c1ccc2[nH]c(cc2c1)-c1cc(ccc1O)-c1ccc(F)cc1
Show InChI InChI=1S/C21H16FN3O/c22-16-5-1-12(2-6-16)13-4-8-20(26)17(10-13)19-11-15-9-14(21(23)24)3-7-18(15)25-19/h1-11,25-26H,(H3,23,24)
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Similars
Article
PubMed
n/an/a 5.90E+3n/an/an/an/an/an/a



Korea University

Curated by ChEMBL


Assay Description
Inhibition of recombinant human hepsin using Boc-QAR-AMC as substrate preincubated for 30 mins followed by substrate addition by fluorescence assay

Eur J Med Chem 118: 208-218 (2016)


Article DOI: 10.1016/j.ejmech.2016.04.033
BindingDB Entry DOI: 10.7270/Q2TX3HB6
More data for this
Ligand-Target Pair