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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M1' and Ligand = 'BDBM50412176'   
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


(Homo sapiens (Human))
BDBM50412176
PNG
(CHEMBL493980)
Show SMILES CN1CCC[C@H]1[C@H]1CS(=O)[C@](O1)(C1CCCCC1)c1ccccc1 |r|
Show InChI InChI=1S/C20H29NO2S/c1-21-14-8-13-18(21)19-15-24(22)20(23-19,16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2,4-5,9-10,17-19H,3,6-8,11-15H2,1H3/t18-,19+,20-,24?/m0/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
10n/an/an/an/an/an/an/an/a



Universit£ di Firenze

Curated by ChEMBL


Assay Description
Displacement of [3H]NMS from human muscarinic M1 receptor expressed in CHO cells


Bioorg Med Chem 16: 5490-500 (2008)


Article DOI: 10.1016/j.bmc.2008.04.013
BindingDB Entry DOI: 10.7270/Q21N82BT
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50412176
PNG
(CHEMBL493980)
Show SMILES CN1CCC[C@H]1[C@H]1CS(=O)[C@](O1)(C1CCCCC1)c1ccccc1 |r|
Show InChI InChI=1S/C20H29NO2S/c1-21-14-8-13-18(21)19-15-24(22)20(23-19,16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2,4-5,9-10,17-19H,3,6-8,11-15H2,1H3/t18-,19+,20-,24?/m0/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
155n/an/an/an/an/an/an/an/a



Universit£ di Firenze

Curated by ChEMBL


Assay Description
Displacement of [3H]NMS from human muscarinic M1 receptor expressed in CHO cells


Bioorg Med Chem 16: 5490-500 (2008)


Article DOI: 10.1016/j.bmc.2008.04.013
BindingDB Entry DOI: 10.7270/Q21N82BT
More data for this
Ligand-Target Pair