BindingDB logo
myBDB logout

BDBM50179326 2-(diethylamino)-5,6-dimethyl-4H-thieno[2,3-d][1,3]oxazin-4-one::2-Diethylamino-5,6-dimethyl-thieno[2,3-d][1,3]oxazin-4-one::CHEMBL444837

SMILES: CCN(CC)c1nc2sc(C)c(C)c2c(=O)o1

InChI Key: InChIKey=HMMASMRUGGJUPA-UHFFFAOYSA-N

Data: 1 KI  1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50179326   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cholesterol esterase


(Bos taurus)
BDBM50179326
PNG
(2-(diethylamino)-5,6-dimethyl-4H-thieno[2,3-d][1,3...)
Show SMILES CCN(CC)c1nc2sc(C)c(C)c2c(=O)o1
Show InChI InChI=1S/C12H16N2O2S/c1-5-14(6-2)12-13-10-9(11(15)16-12)7(3)8(4)17-10/h5-6H2,1-4H3
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
4.30E+3n/an/an/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibitory activity against bovine pancreatic CEase in presence of pNPB chromogenic substrate by spectrophotometry


J Med Chem 48: 8270-88 (2005)


Article DOI: 10.1021/jm0508639
BindingDB Entry DOI: 10.7270/Q2GQ6XB4
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50179326
PNG
(2-(diethylamino)-5,6-dimethyl-4H-thieno[2,3-d][1,3...)
Show SMILES CCN(CC)c1nc2sc(C)c(C)c2c(=O)o1
Show InChI InChI=1S/C12H16N2O2S/c1-5-14(6-2)12-13-10-9(11(15)16-12)7(3)8(4)17-10/h5-6H2,1-4H3
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/a



University of Bonn

Curated by ChEMBL


Assay Description
Inhibitory activity AChE from Electrophorus electricus using ATCh substrate and DTNB by spectrophotometry


J Med Chem 48: 8270-88 (2005)


Article DOI: 10.1021/jm0508639
BindingDB Entry DOI: 10.7270/Q2GQ6XB4
More data for this
Ligand-Target Pair