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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin S' and Monomerid = 50099717   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cathepsin S


(Homo sapiens (Human))
BDBM50099717
PNG
(CHEMBL300241 | [(9,10-Dioxo-9,10-dihydro-phenanthr...)
Show SMILES OC(=O)CNC(=O)c1ccc-2c(c1)C(=O)C(=O)c1ccccc-21
Show InChI InChI=1S/C17H11NO5/c19-14(20)8-18-17(23)9-5-6-11-10-3-1-2-4-12(10)15(21)16(22)13(11)7-9/h1-7H,8H2,(H,18,23)(H,19,20)
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



AstraZeneca Pharmaceuticals

Curated by ChEMBL


Assay Description
Inhibitory concentration against Cathepsin S


J Med Chem 44: 1777-93 (2001)


Article DOI: 10.1021/jm000447i
BindingDB Entry DOI: 10.7270/Q2X34WQQ
More data for this
Ligand-Target Pair