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BDBM50229061 CHEMBL162134

SMILES: OC(=O)C(O)=O.COCCc1noc(n1)C1=CCCN(C)C1

InChI Key: InChIKey=MFLXHEWDNHGBIH-UHFFFAOYSA-N

Data: 2 IC50  1 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50229061   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Muscarinic acetylcholine receptor


(RAT)
BDBM50229061
PNG
(CHEMBL162134)
Show SMILES OC(=O)C(O)=O.COCCc1noc(n1)C1=CCCN(C)C1 |t:15|
Show InChI InChI=1S/C11H17N3O2/c1-14-6-3-4-9(8-14)11-12-10(13-16-11)5-7-15-2/h4H,3,5-8H2,1-2H3
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 144n/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


(Homo sapiens (Human))
BDBM50229061
PNG
(CHEMBL162134)
Show SMILES OC(=O)C(O)=O.COCCc1noc(n1)C1=CCCN(C)C1 |t:15|
Show InChI InChI=1S/C11H17N3O2/c1-14-6-3-4-9(8-14)11-12-10(13-16-11)5-7-15-2/h4H,3,5-8H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

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

Similars

PubMed
n/an/an/an/a 720n/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
Muscarinic acetylcholine receptor


(RAT)
BDBM50229061
PNG
(CHEMBL162134)
Show SMILES OC(=O)C(O)=O.COCCc1noc(n1)C1=CCCN(C)C1 |t:15|
Show InChI InChI=1S/C11H17N3O2/c1-14-6-3-4-9(8-14)11-12-10(13-16-11)5-7-15-2/h4H,3,5-8H2,1-2H3
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 4.15E+4n/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