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BDBM50154167 CHEMBL185533::[1-(1H-Pyrazol-3-ylaminooxalyl)-pentyl]-carbamic acid 2,2-dimethyl-butyl ester

SMILES: CCCC[C@H](NC(=O)OCC(C)(C)CC)C(=O)C(=O)Nc1ccn[nH]1

InChI Key: InChIKey=PORJGUPVXOCUGW-LBPRGKRZSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50154167   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cathepsin K


(Homo sapiens (Human))
BDBM50154167
PNG
(CHEMBL185533 | [1-(1H-Pyrazol-3-ylaminooxalyl)-pen...)
Show SMILES CCCC[C@H](NC(=O)OCC(C)(C)CC)C(=O)C(=O)Nc1ccn[nH]1
Show InChI InChI=1S/C17H28N4O4/c1-5-7-8-12(19-16(24)25-11-17(3,4)6-2)14(22)15(23)20-13-9-10-18-21-13/h9-10,12H,5-8,11H2,1-4H3,(H,19,24)(H2,18,20,21,23)/t12-/m0/s1
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MMDB

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Similars

Article
PubMed
n/an/a 1.60n/an/an/an/an/an/a



GlaxoSmithKline

Curated by ChEMBL


Assay Description
Inhibitory potency against human Cathepsin K


J Med Chem 47: 5049-56 (2004)


Article DOI: 10.1021/jm0400799
BindingDB Entry DOI: 10.7270/Q27H1J39
More data for this
Ligand-Target Pair