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SMILES: [I-].CC[N+](CC)(CC)CCOC(=O)C(c1ccccc1)c1ccccc1

InChI Key: InChIKey=ZMCUJOGARKOVLZ-UHFFFAOYSA-N

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 4 hits for monomerid = 50491127   
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))
BDBM50491127
PNG
(CHEMBL2377383)
Show SMILES [I-].CC[N+](CC)(CC)CCOC(=O)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H30NO2/c1-4-23(5-2,6-3)17-18-25-22(24)21(19-13-9-7-10-14-19)20-15-11-8-12-16-20/h7-16,21H,4-6,17-18H2,1-3H3/q+1
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0.543n/an/an/an/an/an/an/an/a



Walter Reed Army Institute of Research

Curated by ChEMBL


Assay Description
Displacement of [3H] N-methylscopolamine from human muscarinic M3 receptor expressed in CHOK1 cells after 30 mins by scintillation counting analysis


Bioorg Med Chem 21: 2651-62 (2013)


Article DOI: 10.1016/j.bmc.2013.01.072
BindingDB Entry DOI: 10.7270/Q2X92F6X
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50491127
PNG
(CHEMBL2377383)
Show SMILES [I-].CC[N+](CC)(CC)CCOC(=O)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H30NO2/c1-4-23(5-2,6-3)17-18-25-22(24)21(19-13-9-7-10-14-19)20-15-11-8-12-16-20/h7-16,21H,4-6,17-18H2,1-3H3/q+1
UniProtKB/SwissProt

antibodypedia
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5.75n/an/an/an/an/an/an/an/a



Walter Reed Army Institute of Research

Curated by ChEMBL


Assay Description
Displacement of [3H] N-methylscopolamine from human muscarinic M1 receptor expressed in CHOK1 cells after 30 mins by scintillation counting analysis


Bioorg Med Chem 21: 2651-62 (2013)


Article DOI: 10.1016/j.bmc.2013.01.072
BindingDB Entry DOI: 10.7270/Q2X92F6X
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50491127
PNG
(CHEMBL2377383)
Show SMILES [I-].CC[N+](CC)(CC)CCOC(=O)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H30NO2/c1-4-23(5-2,6-3)17-18-25-22(24)21(19-13-9-7-10-14-19)20-15-11-8-12-16-20/h7-16,21H,4-6,17-18H2,1-3H3/q+1
UniProtKB/SwissProt

antibodypedia
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65.5n/an/an/an/an/an/an/an/a



Walter Reed Army Institute of Research

Curated by ChEMBL


Assay Description
Displacement of [3H] N-methylscopolamine from human muscarinic M1 receptor after 30 mins by scintillation counting analysis


Bioorg Med Chem 21: 2651-62 (2013)


Article DOI: 10.1016/j.bmc.2013.01.072
BindingDB Entry DOI: 10.7270/Q2X92F6X
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50491127
PNG
(CHEMBL2377383)
Show SMILES [I-].CC[N+](CC)(CC)CCOC(=O)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C22H30NO2/c1-4-23(5-2,6-3)17-18-25-22(24)21(19-13-9-7-10-14-19)20-15-11-8-12-16-20/h7-16,21H,4-6,17-18H2,1-3H3/q+1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
738n/an/an/an/an/an/an/an/a



Walter Reed Army Institute of Research

Curated by ChEMBL


Assay Description
Displacement of [3H] N-methylscopolamine from human muscarinic M2 receptor expressed in CHOK1 cells after 30 mins by scintillation counting analysis


Bioorg Med Chem 21: 2651-62 (2013)


Article DOI: 10.1016/j.bmc.2013.01.072
BindingDB Entry DOI: 10.7270/Q2X92F6X
More data for this
Ligand-Target Pair