BindingDB logo
myBDB logout

BDBM50044692 3-tert-Butyl-8-methyl-2-thioxo-1-oxa-3,8-diaza-spiro[4.5]decan-4-one; hydrochloride::CHEMBL553865

SMILES: CN1CCC2(CC1)OC(=S)N(C2=O)C(C)(C)C

InChI Key: InChIKey=HGWKWDMGMRKIAK-UHFFFAOYSA-N

Data: 2 KI

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 = 50044692   
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
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50044692
PNG
(3-tert-Butyl-8-methyl-2-thioxo-1-oxa-3,8-diaza-spi...)
Show SMILES CN1CCC2(CC1)OC(=S)N(C2=O)C(C)(C)C
Show InChI InChI=1S/C12H20N2O2S/c1-11(2,3)14-9(15)12(16-10(14)17)5-7-13(4)8-6-12/h5-8H2,1-4H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
210n/an/an/an/an/an/an/an/a



Institute for Drug Discovery Research

Curated by ChEMBL


Assay Description
Displacement of [3H]pirenzepine from rat cortex membrane expressing muscarinic M1 receptor


J Med Chem 36: 2292-9 (1993)


BindingDB Entry DOI: 10.7270/Q2W66MDV
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)
BDBM50044692
PNG
(3-tert-Butyl-8-methyl-2-thioxo-1-oxa-3,8-diaza-spi...)
Show SMILES CN1CCC2(CC1)OC(=S)N(C2=O)C(C)(C)C
Show InChI InChI=1S/C12H20N2O2S/c1-11(2,3)14-9(15)12(16-10(14)17)5-7-13(4)8-6-12/h5-8H2,1-4H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
2.10E+3n/an/an/an/an/an/an/an/a



Institute for Drug Discovery Research

Curated by ChEMBL


Assay Description
Compound tested in vitro for displacement of [3H]quinuclidinyl benzilate from rat cerebellum membrane expressing muscarinic M2 receptor


J Med Chem 36: 2292-9 (1993)


BindingDB Entry DOI: 10.7270/Q2W66MDV
More data for this
Ligand-Target Pair