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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 387.4
BDBM50071932

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
Maltase-glucoamylase


(Homo sapiens (Human))
BDBM50071932
PNG
(CHEMBL3407640)
Show SMILES COc1cccc(\C=N\NC(=O)c2ccc(cc2)-c2nc3ccccc3s2)c1
Show InChI InChI=1S/C22H17N3O2S/c1-27-18-6-4-5-15(13-18)14-23-25-21(26)16-9-11-17(12-10-16)22-24-19-7-2-3-8-20(19)28-22/h2-14H,1H3,(H,25,26)/b23-14+
PDB

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PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 1.11E+4n/an/an/an/an/an/a



Universiti Teknologi MARA (UiTM)

Curated by ChEMBL


Assay Description
Inhibition of alpha-glucosidase (unknown origin) using pNPG substrate incubated for 15 mins by microplate reader based method


Eur J Med Chem 92: 387-400 (2015)


Article DOI: 10.1016/j.ejmech.2015.01.009
BindingDB Entry DOI: 10.7270/Q2H996WX
More data for this
Ligand-Target Pair