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SMILES: O=C(NC1(CC1)C#N)[C@H](CS(=O)(=O)N1CCN(CC1)c1ccccn1)Nc1cccnc1

InChI Key:

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50546796   
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
Cathepsin S


(Homo sapiens (Human))		BDBM50546796
PNG
(CHEMBL4761229)
Show SMILES O=C(NC1(CC1)C#N)[C@H](CS(=O)(=O)N1CCN(CC1)c1ccccn1)Nc1cccnc1 |r|
PDB
MMDB

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PC cid
PC sid
UniChem
Article
 0.25n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant human Cathepsin S expressed in baculovirus infected insect cells using Z-VVR-AMC as substrate preincubated for 15 mins foll...

Citation and Details

Article DOI: 10.1021/acs.jmedchem.0c00949
BindingDB Entry DOI: 10.7270/Q2NV9NVM
More data for this
Ligand-Target Pair