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BDBM50229393 CHEMBL74426

SMILES: CC(C#CCN1CCCC1)N1CCN(C)C1=O

InChI Key: InChIKey=KPDAZKLVALJBHP-UHFFFAOYSA-N

Data: 2 KI

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50229393   
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)
BDBM50229393
PNG
(CHEMBL74426)
Show SMILES CC(C#CCN1CCCC1)N1CCN(C)C1=O
Show InChI InChI=1S/C13H21N3O/c1-12(16-11-10-14(2)13(16)17)6-5-9-15-7-3-4-8-15/h12H,3-4,7-11H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

PubMed
13n/an/an/an/an/an/an/an/a



Upjohn Company

Curated by ChEMBL


Assay Description
Binding affinity to muscarinic acetylcholine receptor was determined in presence of [3H]OXO-M radioligand (in vitro)


J Med Chem 34: 2314-27 (1991)


BindingDB Entry DOI: 10.7270/Q2057J5V
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229393
PNG
(CHEMBL74426)
Show SMILES CC(C#CCN1CCCC1)N1CCN(C)C1=O
Show InChI InChI=1S/C13H21N3O/c1-12(16-11-10-14(2)13(16)17)6-5-9-15-7-3-4-8-15/h12H,3-4,7-11H2,1-2H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

PubMed
130n/an/an/an/an/an/an/an/a



Upjohn Company

Curated by ChEMBL


Assay Description
Binding affinity to muscarinic acetylcholine receptor was determined in presence of [3H]QNB radioligand (in vitro)


J Med Chem 34: 2314-27 (1991)


BindingDB Entry DOI: 10.7270/Q2057J5V
More data for this
Ligand-Target Pair