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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin K' and Ligand = 'BDBM50418002'   
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 K


(Homo sapiens (Human))
BDBM50418002
PNG
(CHEMBL1672427)
Show SMILES Brc1ccc(Br)c(c1)S(=O)(=O)N[C@@H]1CCN(C1)C#N |r|
Show InChI InChI=1S/C11H11Br2N3O2S/c12-8-1-2-10(13)11(5-8)19(17,18)15-9-3-4-16(6-9)7-14/h1-2,5,9,15H,3-4,6H2/t9-/m1/s1
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MMDB

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Similars

Article
PubMed
n/an/a 2n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of human recombinant cathepsin K after 1 hr


ACS Med Chem Lett 2: 142-147 (2011)


Article DOI: 10.1021/ml100212k
BindingDB Entry DOI: 10.7270/Q2RX9DBM
More data for this
Ligand-Target Pair