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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cathepsin K' and Ligand = 'BDBM19675'   
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))
BDBM19675
PNG
((2S)-4-(morpholin-4-yl)-4-oxo-N-(2-{[4-(trifluorom...)
Show SMILES FC(F)(F)Oc1ccc(NCCNC(=O)[C@@H](CC(=O)N2CCOCC2)c2ccc(cc2)C(F)(F)F)cc1 |r|
Show InChI InChI=1S/C24H25F6N3O4/c25-23(26,27)17-3-1-16(2-4-17)20(15-21(34)33-11-13-36-14-12-33)22(35)32-10-9-31-18-5-7-19(8-6-18)37-24(28,29)30/h1-8,20,31H,9-15H2,(H,32,35)/t20-/m0/s1
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Similars

Article
PubMed
>1.00E+5n/an/an/an/an/an/an/an/a



GNF



Assay Description
The recombinant human cathepsin enzyme was preincubated with inhibitor for 20 minutes prior to addition of substrate. The substrate hydrolysis was mo...


Bioorg Med Chem Lett 17: 2899-903 (2007)


Article DOI: 10.1016/j.bmcl.2007.02.049
BindingDB Entry DOI: 10.7270/Q2K64GBR
More data for this
Ligand-Target Pair