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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 410.2
BDBM50546055

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 2 hits in this display   
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


(Homo sapiens (Human))
BDBM50546055
PNG
(CHEMBL4762280)
Show SMILES Cc1c(Cl)nnc2sc(C(=O)NC3CN(C3)c3cnc(Cl)cn3)c(N)c12
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 400n/an/an/an/a


TBA

Assay Description
Positive allosteric modulation of human M2 receptor/Gqi5 in presence of EC20 glutamate by calcium mobilization assay


Citation and Details

Article DOI: 10.1016/j.bmcl.2019.05.026
BindingDB Entry DOI: 10.7270/Q2JM2F6M
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50546055
PNG
(CHEMBL4762280)
Show SMILES Cc1c(Cl)nnc2sc(C(=O)NC3CN(C3)c3cnc(Cl)cn3)c(N)c12
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 140n/an/an/an/a


TBA

Assay Description
Positive allosteric modulation of human M4 receptor/Gqi5 in presence of EC20 glutamate by calcium mobilization assay


Citation and Details

Article DOI: 10.1016/j.bmcl.2019.05.026
BindingDB Entry DOI: 10.7270/Q2JM2F6M
More data for this
Ligand-Target Pair