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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 = 'BDBM50062588'   
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)
BDBM50062588
PNG
(3-(3-Butoxy-pyrazin-2-yloxy)-1-aza-bicyclo[2.2.2]o...)
Show SMILES CCCCOc1nccnc1OC1CN2CCC1CC2 |(8.29,-14.19,;9.45,-13.17,;9.13,-11.65,;10.29,-10.62,;9.97,-9.12,;11.3,-8.36,;12.65,-9.13,;13.98,-8.36,;13.98,-6.81,;12.65,-6.05,;11.32,-6.82,;9.99,-6.05,;8.64,-6.82,;8.64,-8.36,;7.31,-9.12,;6,-8.36,;6,-6.82,;7.31,-6.04,;6.56,-7.38,;8.08,-7.78,)|
Show InChI InChI=1S/C15H23N3O2/c1-2-3-10-19-14-15(17-7-6-16-14)20-13-11-18-8-4-12(13)5-9-18/h6-7,12-13H,2-5,8-11H2,1H3
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UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 22.3n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for muscarinic acetylcholine receptor M1 using [3H]-Pirenzepine (Pz) radioligand in rat hippocampus membranes.


J Med Chem 41: 379-92 (1998)


Article DOI: 10.1021/jm970125n
BindingDB Entry DOI: 10.7270/Q2SX6CBC
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50062588
PNG
(3-(3-Butoxy-pyrazin-2-yloxy)-1-aza-bicyclo[2.2.2]o...)
Show SMILES CCCCOc1nccnc1OC1CN2CCC1CC2 |(8.29,-14.19,;9.45,-13.17,;9.13,-11.65,;10.29,-10.62,;9.97,-9.12,;11.3,-8.36,;12.65,-9.13,;13.98,-8.36,;13.98,-6.81,;12.65,-6.05,;11.32,-6.82,;9.99,-6.05,;8.64,-6.82,;8.64,-8.36,;7.31,-9.12,;6,-8.36,;6,-6.82,;7.31,-6.04,;6.56,-7.38,;8.08,-7.78,)|
Show InChI InChI=1S/C15H23N3O2/c1-2-3-10-19-14-15(17-7-6-16-14)20-13-11-18-8-4-12(13)5-9-18/h6-7,12-13H,2-5,8-11H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 38n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for muscarinic acetylcholine receptor M1 using [3H]-oxotremorine-M (Oxo-M) radioligand in rat hippocampus membranes


J Med Chem 41: 379-92 (1998)


Article DOI: 10.1021/jm970125n
BindingDB Entry DOI: 10.7270/Q2SX6CBC
More data for this
Ligand-Target Pair