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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 Monomerid = 50071185   
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))
BDBM50071185
PNG
(8,9-Dimethoxy-2-methyl-11,12-dihydro-3H,6aH,13H-6-...)
Show SMILES COc1cc2CCN3Cc4c(OC3c2cc1OC)ccc1[nH]c(C)cc41
Show InChI InChI=1/C21H22N2O3/c1-12-8-15-16-11-23-7-6-13-9-19(24-2)20(25-3)10-14(13)21(23)26-18(16)5-4-17(15)22-12/h4-5,8-10,21-22H,6-7,11H2,1-3H3
UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.27E+4n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research

Curated by ChEMBL


Assay Description
Evaluated for its binding affinity at human muscarinic receptor m1 by displacement of [3H]NMS binding using membranes in transfected chinese hamster ...


Bioorg Med Chem Lett 8: 1991-6 (1999)


Article DOI: 10.1016/s0960-894x(98)00351-5
BindingDB Entry DOI: 10.7270/Q2FB53F2
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M5 chimeric protein


(Homo sapiens (Human))
BDBM50071185
PNG
(8,9-Dimethoxy-2-methyl-11,12-dihydro-3H,6aH,13H-6-...)
Show SMILES COc1cc2CCN3Cc4c(OC3c2cc1OC)ccc1[nH]c(C)cc41
Show InChI InChI=1/C21H22N2O3/c1-12-8-15-16-11-23-7-6-13-9-19(24-2)20(25-3)10-14(13)21(23)26-18(16)5-4-17(15)22-12/h4-5,8-10,21-22H,6-7,11H2,1-3H3
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.35E+4n/an/an/an/an/an/a



Parke-Davis Pharmaceutical Research

Curated by ChEMBL


Assay Description
Evaluated for its binding affinity at human muscarinic receptor m5 by the displacement of [3H]NMS binding using membranes from transfected chinese ha...


Bioorg Med Chem Lett 8: 1991-6 (1999)


Article DOI: 10.1016/s0960-894x(98)00351-5
BindingDB Entry DOI: 10.7270/Q2FB53F2
More data for this
Ligand-Target Pair