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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M1/M2/M3/M4/M5' and Ligand = 'BDBM50229048'   
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/M2/M3/M4/M5


(RAT)
BDBM50229048
PNG
(CHEMBL349844)
Show SMILES OC(=O)C(O)=O.CN1CCC=C(C1)c1noc(C)n1 |c:9|
Show InChI InChI=1S/C9H13N3O/c1-7-10-9(11-13-7)8-4-3-5-12(2)6-8/h4H,3,5-6H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 955n/an/an/an/an/an/a



Ferrosan A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity to muscarinic acetylcholine receptor site in rat brain assayed using [3H]oxotremorine-M as the radioligand.


J Med Chem 34: 687-92 (1991)


BindingDB Entry DOI: 10.7270/Q2RN3B25
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50229048
PNG
(CHEMBL349844)
Show SMILES OC(=O)C(O)=O.CN1CCC=C(C1)c1noc(C)n1 |c:9|
Show InChI InChI=1S/C9H13N3O/c1-7-10-9(11-13-7)8-4-3-5-12(2)6-8/h4H,3,5-6H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 4.01E+5n/an/an/an/an/an/a



Ferrosan A/S

Curated by ChEMBL


Assay Description
In Vitro binding affinity to the muscarinic acetylcholine receptor site in rat brain by using [3H]QNB as the radioligand.


J Med Chem 34: 687-92 (1991)


BindingDB Entry DOI: 10.7270/Q2RN3B25
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(Homo sapiens (Human))
BDBM50229048
PNG
(CHEMBL349844)
Show SMILES OC(=O)C(O)=O.CN1CCC=C(C1)c1noc(C)n1 |c:9|
Show InChI InChI=1S/C9H13N3O/c1-7-10-9(11-13-7)8-4-3-5-12(2)6-8/h4H,3,5-6H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/an/an/a>3.00E+4n/an/an/an/a



Ferrosan A/S

Curated by ChEMBL


Assay Description
Agonist activity at muscarinic acetylcholine receptor in isolated guinea pig ileum.


J Med Chem 34: 687-92 (1991)


BindingDB Entry DOI: 10.7270/Q2RN3B25
More data for this
Ligand-Target Pair