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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M1' and Ligand = 'BDBM50316220'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50316220
PNG
((2-(1,2,5,6-Tetrahydro-1-methylpyridin-3-yl)morpho...)
Show SMILES CN1CCC=C(C1)C1CN(CCO1)C(=O)c1cccc(c1)[N+]([O-])=O |c:4|
Show InChI InChI=1S/C17H21N3O4/c1-18-7-3-5-14(11-18)16-12-19(8-9-24-16)17(21)13-4-2-6-15(10-13)20(22)23/h2,4-6,10,16H,3,7-9,11-12H2,1H3
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UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
4.80E+4n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex after 2 hrs by liquid scintillation counting


Bioorg Med Chem 17: 5526-34 (2009)


Article DOI: 10.1016/j.bmc.2009.06.032
BindingDB Entry DOI: 10.7270/Q2P55NP8
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50316220
PNG
((2-(1,2,5,6-Tetrahydro-1-methylpyridin-3-yl)morpho...)
Show SMILES CN1CCC=C(C1)C1CN(CCO1)C(=O)c1cccc(c1)[N+]([O-])=O |c:4|
Show InChI InChI=1S/C17H21N3O4/c1-18-7-3-5-14(11-18)16-12-19(8-9-24-16)17(21)13-4-2-6-15(10-13)20(22)23/h2,4-6,10,16H,3,7-9,11-12H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.42E+5n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex after 2 hrs by liquid scintillation counting


Bioorg Med Chem 17: 5526-34 (2009)


Article DOI: 10.1016/j.bmc.2009.06.032
BindingDB Entry DOI: 10.7270/Q2P55NP8
More data for this
Ligand-Target Pair