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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M2' and Ligand = 'BDBM50018295'   
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 M2


(RAT)
BDBM50018295
PNG
(11-(2-Diethylaminomethyl-piperidine-1-carbonyl)-5,...)
Show SMILES CCN(CC)CC1CCCCN1C(=O)N1c2ccccc2C(=O)Nc2cccnc12
Show InChI InChI=1S/C23H29N5O2/c1-3-26(4-2)16-17-10-7-8-15-27(17)23(30)28-20-13-6-5-11-18(20)22(29)25-19-12-9-14-24-21(19)28/h5-6,9,11-14,17H,3-4,7-8,10,15-16H2,1-2H3,(H,25,29)
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PC cid
PC sid
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Similars

PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



College of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of muscarinic (M2) receptor isolated from rat atria


J Med Chem 37: 3775-88 (1994)


BindingDB Entry DOI: 10.7270/Q2QC02JX
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)
BDBM50018295
PNG
(11-(2-Diethylaminomethyl-piperidine-1-carbonyl)-5,...)
Show SMILES CCN(CC)CC1CCCCN1C(=O)N1c2ccccc2C(=O)Nc2cccnc12
Show InChI InChI=1S/C23H29N5O2/c1-3-26(4-2)16-17-10-7-8-15-27(17)23(30)28-20-13-6-5-11-18(20)22(29)25-19-12-9-14-24-21(19)28/h5-6,9,11-14,17H,3-4,7-8,10,15-16H2,1-2H3,(H,25,29)
PDB

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KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 5.00E+3n/an/an/an/an/an/a



Dr. Karl Thomae GmbH

Curated by ChEMBL


Assay Description
Binding affinity to the rat cardiac muscarinic acetylcholine receptor M2 using 0.3 nM [3H]-N-methylscopolamine as radioligand


J Med Chem 32: 1718-24 (1989)


BindingDB Entry DOI: 10.7270/Q2XG9Q4Q
More data for this
Ligand-Target Pair