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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 333.4
BDBM50242627

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
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
Non-lysosomal glucosylceramidase


(Homo sapiens (Human))
BDBM50242627
PNG
(CHEMBL485840 | N-carboxynonyldeoxynojirimycin)
Show SMILES CCCCCCCCCOC(=O)N1C[C@H](O)[C@@H](O)[C@H](O)[C@H]1CO |r|
Show InChI InChI=1S/C16H31NO6/c1-2-3-4-5-6-7-8-9-23-16(22)17-10-13(19)15(21)14(20)12(17)11-18/h12-15,18-21H,2-11H2,1H3/t12-,13+,14-,15-/m1/s1
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KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 20n/an/an/an/an/an/a



University of Oxford

Curated by ChEMBL


Assay Description
Inhibition of bile acid beta-glucosidase activity of human liver GBA2


J Biol Chem 282: 32655-64 (2007)


Article DOI: 10.1074/jbc.M702387200
BindingDB Entry DOI: 10.7270/Q2QJ7H2D
More data for this
Ligand-Target Pair