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BDBM50061702 (1R,3R,4R)-1-Aza-bicyclo[2.2.1]heptane-3-carbaldehyde O-methyl-oxime::CHEMBL132698

SMILES: CO\N=C\[C@H]1C[N@@]2CC[C@H]1C2

InChI Key: InChIKey=IQCCZGULZZAZRT-JMJMLWOWSA-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 = 50061702   
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 M3


(Homo sapiens (Human))
BDBM50061702
PNG
((1R,3R,4R)-1-Aza-bicyclo[2.2.1]heptane-3-carbaldeh...)
Show SMILES CO\N=C\[C@H]1C[N@@]2CC[C@H]1C2
Show InChI InChI=1S/C8H14N2O/c1-11-9-4-8-6-10-3-2-7(8)5-10/h4,7-8H,2-3,5-6H2,1H3/b9-4+/t7-,8-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 2.20E+3n/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) 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 M2


(Homo sapiens (Human))
BDBM50061702
PNG
((1R,3R,4R)-1-Aza-bicyclo[2.2.1]heptane-3-carbaldeh...)
Show SMILES CO\N=C\[C@H]1C[N@@]2CC[C@H]1C2
Show InChI InChI=1S/C8H14N2O/c1-11-9-4-8-6-10-3-2-7(8)5-10/h4,7-8H,2-3,5-6H2,1H3/b9-4+/t7-,8-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 220n/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) 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)
BDBM50061702
PNG
((1R,3R,4R)-1-Aza-bicyclo[2.2.1]heptane-3-carbaldeh...)
Show SMILES CO\N=C\[C@H]1C[N@@]2CC[C@H]1C2
Show InChI InChI=1S/C8H14N2O/c1-11-9-4-8-6-10-3-2-7(8)5-10/h4,7-8H,2-3,5-6H2,1H3/b9-4+/t7-,8-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
n/an/a 3.10E+3n/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8FXR
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50061702
PNG
((1R,3R,4R)-1-Aza-bicyclo[2.2.1]heptane-3-carbaldeh...)
Show SMILES CO\N=C\[C@H]1C[N@@]2CC[C@H]1C2
Show InChI InChI=1S/C8H14N2O/c1-11-9-4-8-6-10-3-2-7(8)5-10/h4,7-8H,2-3,5-6H2,1H3/b9-4+/t7-,8-/m0/s1
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.10E+3n/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) 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)
BDBM50061702
PNG
((1R,3R,4R)-1-Aza-bicyclo[2.2.1]heptane-3-carbaldeh...)
Show SMILES CO\N=C\[C@H]1C[N@@]2CC[C@H]1C2
Show InChI InChI=1S/C8H14N2O/c1-11-9-4-8-6-10-3-2-7(8)5-10/h4,7-8H,2-3,5-6H2,1H3/b9-4+/t7-,8-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
n/an/a 15n/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q20V8FXR
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50061702
PNG
((1R,3R,4R)-1-Aza-bicyclo[2.2.1]heptane-3-carbaldeh...)
Show SMILES CO\N=C\[C@H]1C[N@@]2CC[C@H]1C2
Show InChI InChI=1S/C8H14N2O/c1-11-9-4-8-6-10-3-2-7(8)5-10/h4,7-8H,2-3,5-6H2,1H3/b9-4+/t7-,8-/m0/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/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