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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M2' and Ligand = 'BDBM50474563'   
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


(GUINEA PIG)		BDBM50474563
PNG
(CHEMBL284962)
Show SMILES C[N+](C)(CCCCCC[N+](C)(C)CCCN1C(=O)CC2c3ccccc3C(c3ccccc23)C1=O)CCCN1C(=O)c2ccccc2C1=O |TLB:21:20:27.32:33.15.16.18,31:32:25.20:33.15.16.18,34:33:27.32:25.20,THB:17:16:27.32:25.20,28:27:25.20:33.15.16.18,24:25:27.32:33.15.16.18,(6.23,-3.34,;5.14,-4.44,;4.04,-5.54,;6.68,-4.44,;7.45,-5.77,;8.99,-5.77,;9.76,-7.12,;11.3,-7.12,;12.07,-8.45,;13.61,-8.45,;14.38,-7.1,;12.84,-9.78,;14.38,-9.78,;15.92,-9.78,;16.69,-11.11,;18.23,-11.11,;19.14,-12.35,;18.67,-13.82,;20.56,-11.95,;23.25,-12.35,;23.25,-10.34,;24.58,-9.57,;24.58,-8.03,;23.25,-7.26,;21.92,-8.03,;21.92,-9.57,;20.6,-10.34,;20.73,-12.47,;19.42,-13.26,;19.44,-14.79,;20.8,-15.54,;22.1,-14.75,;22.08,-13.21,;19.14,-9.85,;18.67,-8.4,;4.37,-3.11,;2.83,-3.11,;2.06,-1.78,;.52,-1.78,;-.39,-.54,;.09,.93,;-1.87,-1,;-3.24,-.22,;-4.57,-1.01,;-4.57,-2.57,;-3.21,-3.34,;-1.87,-2.57,;-.39,-3.04,;.08,-4.5,)|
Show InChI InChI=1S/C41H52N4O4/c1-44(2,25-13-5-6-14-26-45(3,4)28-16-24-43-39(47)34-21-11-12-22-35(34)40(43)48)27-15-23-42-37(46)29-36-30-17-7-9-19-32(30)38(41(42)49)33-20-10-8-18-31(33)36/h7-12,17-22,36,38H,5-6,13-16,23-29H2,1-4H3/q+2
PDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 398n/an/an/an/a



University of Wuerzburg

Curated by ChEMBL


Assay Description
Ability to dissociate radioligand [3H]NMS from muscarinic acetylcholine receptor M2 of porcine heart

J Med Chem 46: 1390-407 (2003)


Article DOI: 10.1021/jm021077w
BindingDB Entry DOI: 10.7270/Q2JD50JS
More data for this
Ligand-Target Pair