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BDBM210880 US9290467, 50

SMILES: Fc1ccc2OCCCCOc3ccc(C[C@H](NC(=O)c2c1F)C(=O)NC1(CC1)C#N)cc3Cl

InChI Key: InChIKey=NBOCLAVUAMVTPH-KRWDZBQOSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 210880   
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))		BDBM210880
PNG
(US9290467, 50)
Show SMILES Fc1ccc2OCCCCOc3ccc(C[C@H](NC(=O)c2c1F)C(=O)NC1(CC1)C#N)cc3Cl |r|
Show InChI InChI=1S/C24H22ClF2N3O4/c25-15-11-14-3-5-18(15)33-9-1-2-10-34-19-6-4-16(26)21(27)20(19)23(32)29-17(12-14)22(31)30-24(13-28)7-8-24/h3-6,11,17H,1-2,7-10,12H2,(H,29,32)(H,30,31)/t17-/m0/s1
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PC cid
PC sid
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US Patent
n/an/a 13.5n/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