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BDBM50061707 (1-Aza-bicyclo[3.2.1]oct-5-yl)-[(Z)-methoxyimino]-acetonitrile::CHEMBL135645

SMILES: CO\N=C(/C#N)C12CCN(C1)CCC2

InChI Key: InChIKey=WJIDIDMJHVMZSA-FMIVXFBMSA-N

Data: 6 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 6 hits for monomerid = 50061707   
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 M4


(Homo sapiens (Human))
BDBM50061707
PNG
((1-Aza-bicyclo[3.2.1]oct-5-yl)-[(Z)-methoxyimino]-...)
Show SMILES CO\N=C(/C#N)C12CCN(C1)CCC2
Show InChI InChI=1S/C10H15N3O/c1-14-12-9(7-11)10-3-2-5-13(8-10)6-4-10/h2-6,8H2,1H3/b12-9+
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 49n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, usingquinuclidynyl benzylate (QNB) radioligand in human cloned Muscarinic acetylcholine receptor M4


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50061707
PNG
((1-Aza-bicyclo[3.2.1]oct-5-yl)-[(Z)-methoxyimino]-...)
Show SMILES CO\N=C(/C#N)C12CCN(C1)CCC2
Show InChI InChI=1S/C10H15N3O/c1-14-12-9(7-11)10-3-2-5-13(8-10)6-4-10/h2-6,8H2,1H3/b12-9+
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 99n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity against human Muscarinic acetylcholine receptor M1 using quinuclidynyl benzylate (QNB)


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50061707
PNG
((1-Aza-bicyclo[3.2.1]oct-5-yl)-[(Z)-methoxyimino]-...)
Show SMILES CO\N=C(/C#N)C12CCN(C1)CCC2
Show InChI InChI=1S/C10H15N3O/c1-14-12-9(7-11)10-3-2-5-13(8-10)6-4-10/h2-6,8H2,1H3/b12-9+
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

n/an/a 220n/an/an/an/an/an/a


TBA

Assay Description
In vitro inhibition of [3H]quinuclidinyl benzilate (QNB) binding to muscarinic receptors of rat cerebral cortex


Citation and Details

BindingDB Entry DOI: 10.7270/Q2W37ZG7
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50061707
PNG
((1-Aza-bicyclo[3.2.1]oct-5-yl)-[(Z)-methoxyimino]-...)
Show SMILES CO\N=C(/C#N)C12CCN(C1)CCC2
Show InChI InChI=1S/C10H15N3O/c1-14-12-9(7-11)10-3-2-5-13(8-10)6-4-10/h2-6,8H2,1H3/b12-9+
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 31n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidinyl benzilate (QNB) as radioligand in human cloned Muscarinic acetylcholine receptor ...


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50061707
PNG
((1-Aza-bicyclo[3.2.1]oct-5-yl)-[(Z)-methoxyimino]-...)
Show SMILES CO\N=C(/C#N)C12CCN(C1)CCC2
Show InChI InChI=1S/C10H15N3O/c1-14-12-9(7-11)10-3-2-5-13(8-10)6-4-10/h2-6,8H2,1H3/b12-9+
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

n/an/a 11n/an/an/an/an/an/a


TBA

Assay Description
In vitro inhibition of oxotremorine-M (OXO-M) binding to muscarinic receptors of rat cerebral cortex


Citation and Details

BindingDB Entry DOI: 10.7270/Q2W37ZG7
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50061707
PNG
((1-Aza-bicyclo[3.2.1]oct-5-yl)-[(Z)-methoxyimino]-...)
Show SMILES CO\N=C(/C#N)C12CCN(C1)CCC2
Show InChI InChI=1S/C10H15N3O/c1-14-12-9(7-11)10-3-2-5-13(8-10)6-4-10/h2-6,8H2,1H3/b12-9+
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 28n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidynyl benzylate (QNB)radioligand in human cloned Muscarinic acetylcholine receptor M3


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair