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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor' and Ligand = 'BDBM50229536'   
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


(RAT)
BDBM50229536
PNG
(CHEMBL329321)
Show SMILES COC(=O)[C@@H]1C[C@H]2CC[N@@](C2)C1
Show InChI InChI=1S/C9H15NO2/c1-12-9(11)8-4-7-2-3-10(5-7)6-8/h7-8H,2-6H2,1H3/t7-,8-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 77n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
The compound was tested in vitro for central muscarinic acetylcholine receptor affinity to displace [3H]oxotremorine-M from rat cerebral cortex; Valu...


J Med Chem 34: 2726-35 (1991)


Article DOI: 10.1021/jm00113a009
BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229536
PNG
(CHEMBL329321)
Show SMILES COC(=O)[C@@H]1C[C@H]2CC[N@@](C2)C1
Show InChI InChI=1S/C9H15NO2/c1-12-9(11)8-4-7-2-3-10(5-7)6-8/h7-8H,2-6H2,1H3/t7-,8-/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.20E+4n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
The compound was tested in vitro for central muscarinic acetylcholine receptor affinity to displace [3H]quinuclidinyl benzilate from rat cerebral cor...


J Med Chem 34: 2726-35 (1991)


Article DOI: 10.1021/jm00113a009
BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair