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BDBM210851 US9290467, 21

SMILES: Clc1cc2C[C@H](NC(=O)c3ccccc3NC\C=C\COc1cc2)C(=O)NC1(CC1)C#N

InChI Key: InChIKey=IOGJMUCBXABXJY-YADGQWAMSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 210851   
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))
BDBM210851
PNG
(US9290467, 21)
Show SMILES Clc1cc2C[C@H](NC(=O)c3ccccc3NC\C=C\COc1cc2)C(=O)NC1(CC1)C#N |r,t:18|
Show InChI InChI=1S/C24H23ClN4O3/c25-18-13-16-7-8-21(18)32-12-4-3-11-27-19-6-2-1-5-17(19)22(30)28-20(14-16)23(31)29-24(15-26)9-10-24/h1-8,13,20,27H,9-12,14H2,(H,28,30)(H,29,31)/b4-3+/t20-/m0/s1
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PC cid
PC sid
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US Patent
n/an/a 54n/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