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SMILES: Clc1cc2C[C@H](NC(=O)C3CCCN3CC\C=C\COc1cc2)C(=O)NC1(CC1)C#N

InChI Key: InChIKey=MCAYUIJQWRSBTG-ZZMJOKEISA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 210842   
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
Procathepsin L


(Homo sapiens (Human))		BDBM210842
PNG
(US9290467, 12)
Show SMILES Clc1cc2C[C@H](NC(=O)C3CCCN3CC\C=C\COc1cc2)C(=O)NC1(CC1)C#N |r,t:17|
Show InChI InChI=1S/C23H27ClN4O3/c24-17-13-16-6-7-20(17)31-12-3-1-2-10-28-11-4-5-19(28)22(30)26-18(14-16)21(29)27-23(15-25)8-9-23/h1,3,6-7,13,18-19H,2,4-5,8-12,14H2,(H,26,30)(H,27,29)/b3-1+/t18-,19?/m0/s1
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PC cid
PC sid
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US Patent
n/an/a 878n/an/an/an/a6.5n/a



HOFFMANN—LA ROCHE INC.

US Patent


Assay Description
Enzyme activity is measured by observing the increase in fluorescence intensity caused by cleavage of a peptide substrate containing a fluorophore wh...

US Patent US9290467 (2016)


BindingDB Entry DOI: 10.7270/Q2H130VZ
More data for this
Ligand-Target Pair