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3 similar compounds to monomer 50006245

Compile data set for download or QSAR
Wt: 172.2
BDBM50006244
Wt: 172.2
BDBM50006246
Wt: 172.2
BDBM50006247

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 9 hits for monomerid = 50006244,50006246,50006247   
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 M2


(RAT)
BDBM50006246
PNG
(CHEMBL56734 | Trimethyl-(5-methyl-4-oxo-tetrahydro...)
Show SMILES C[C@@H]1O[C@H](C[N+](C)(C)C)CC1=O
Show InChI InChI=1S/C9H18NO2/c1-7-9(11)5-8(12-7)6-10(2,3)4/h7-8H,5-6H2,1-4H3/q+1/t7-,8-/m0/s1
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Article
PubMed
90n/an/an/an/an/an/an/an/a



Istituto Chimico-Farmaceutico dell'Università

Curated by ChEMBL


Assay Description
Binding affinity of the compound to m-AcChR subtype Muscarinic acetylcholine receptor M2 of rat heart


J Med Chem 35: 1915-20 (1992)


Article DOI: 10.1021/jm00088a029
BindingDB Entry DOI: 10.7270/Q2ZS2VF5
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)
BDBM50006246
PNG
(CHEMBL56734 | Trimethyl-(5-methyl-4-oxo-tetrahydro...)
Show SMILES C[C@@H]1O[C@H](C[N+](C)(C)C)CC1=O
Show InChI InChI=1S/C9H18NO2/c1-7-9(11)5-8(12-7)6-10(2,3)4/h7-8H,5-6H2,1-4H3/q+1/t7-,8-/m0/s1
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690n/an/an/an/an/an/an/an/a



Istituto Chimico-Farmaceutico dell'Università

Curated by ChEMBL


Assay Description
Binding affinity of the compound to m-AcChR subtype Muscarinic acetylcholine receptor M3 of rat sabmandibular glands


J Med Chem 35: 1915-20 (1992)


Article DOI: 10.1021/jm00088a029
BindingDB Entry DOI: 10.7270/Q2ZS2VF5
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50006246
PNG
(CHEMBL56734 | Trimethyl-(5-methyl-4-oxo-tetrahydro...)
Show SMILES C[C@@H]1O[C@H](C[N+](C)(C)C)CC1=O
Show InChI InChI=1S/C9H18NO2/c1-7-9(11)5-8(12-7)6-10(2,3)4/h7-8H,5-6H2,1-4H3/q+1/t7-,8-/m0/s1
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1.60E+3n/an/an/an/an/an/an/an/a



Istituto Chimico-Farmaceutico dell'Università

Curated by ChEMBL


Assay Description
Binding affinity of the compound to m-AcChR subtype M1 of rat cerebral cortex


J Med Chem 35: 1915-20 (1992)


Article DOI: 10.1021/jm00088a029
BindingDB Entry DOI: 10.7270/Q2ZS2VF5
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)
BDBM50006247
PNG
(CHEMBL59085 | Trimethyl-(5-methyl-4-oxo-tetrahydro...)
Show SMILES C[C@H]1O[C@H](C[N+](C)(C)C)CC1=O
Show InChI InChI=1S/C9H18NO2/c1-7-9(11)5-8(12-7)6-10(2,3)4/h7-8H,5-6H2,1-4H3/q+1/t7-,8+/m1/s1
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4.00E+3n/an/an/an/an/an/an/an/a



Istituto Chimico-Farmaceutico dell'Università

Curated by ChEMBL


Assay Description
Binding affinity of the compound against m-AcChR subtype Muscarinic acetylcholine receptor M2 of rat heart.


J Med Chem 35: 1915-20 (1992)


Article DOI: 10.1021/jm00088a029
BindingDB Entry DOI: 10.7270/Q2ZS2VF5
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)
BDBM50006244
PNG
(CHEMBL294470 | Trimethyl-(5-methyl-4-oxo-tetrahydr...)
Show SMILES C[C@H]1O[C@@H](C[N+](C)(C)C)CC1=O
Show InChI InChI=1S/C9H18NO2/c1-7-9(11)5-8(12-7)6-10(2,3)4/h7-8H,5-6H2,1-4H3/q+1/t7-,8-/m1/s1
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5.64E+3n/an/an/an/an/an/an/an/a



Istituto Chimico-Farmaceutico dell'Università

Curated by ChEMBL


Assay Description
Binding affinity of the compound against m-AcChR subtype Muscarinic acetylcholine receptor M2 of rat heart.


J Med Chem 35: 1915-20 (1992)


Article DOI: 10.1021/jm00088a029
BindingDB Entry DOI: 10.7270/Q2ZS2VF5
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)
BDBM50006244
PNG
(CHEMBL294470 | Trimethyl-(5-methyl-4-oxo-tetrahydr...)
Show SMILES C[C@H]1O[C@@H](C[N+](C)(C)C)CC1=O
Show InChI InChI=1S/C9H18NO2/c1-7-9(11)5-8(12-7)6-10(2,3)4/h7-8H,5-6H2,1-4H3/q+1/t7-,8-/m1/s1
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9.55E+3n/an/an/an/an/an/an/an/a



Istituto Chimico-Farmaceutico dell'Università

Curated by ChEMBL


Assay Description
Binding affinity of the compound against m-AcChR subtype Muscarinic acetylcholine receptor M3 of rat sabmandibular glands


J Med Chem 35: 1915-20 (1992)


Article DOI: 10.1021/jm00088a029
BindingDB Entry DOI: 10.7270/Q2ZS2VF5
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50006244
PNG
(CHEMBL294470 | Trimethyl-(5-methyl-4-oxo-tetrahydr...)
Show SMILES C[C@H]1O[C@@H](C[N+](C)(C)C)CC1=O
Show InChI InChI=1S/C9H18NO2/c1-7-9(11)5-8(12-7)6-10(2,3)4/h7-8H,5-6H2,1-4H3/q+1/t7-,8-/m1/s1
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PubMed
1.86E+4n/an/an/an/an/an/an/an/a



Istituto Chimico-Farmaceutico dell'Università

Curated by ChEMBL


Assay Description
Binding affinity of the compound against m-AcChR subtype M1 of rat cerebral cortex.


J Med Chem 35: 1915-20 (1992)


Article DOI: 10.1021/jm00088a029
BindingDB Entry DOI: 10.7270/Q2ZS2VF5
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)
BDBM50006247
PNG
(CHEMBL59085 | Trimethyl-(5-methyl-4-oxo-tetrahydro...)
Show SMILES C[C@H]1O[C@H](C[N+](C)(C)C)CC1=O
Show InChI InChI=1S/C9H18NO2/c1-7-9(11)5-8(12-7)6-10(2,3)4/h7-8H,5-6H2,1-4H3/q+1/t7-,8+/m1/s1
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2.12E+4n/an/an/an/an/an/an/an/a



Istituto Chimico-Farmaceutico dell'Università

Curated by ChEMBL


Assay Description
Binding affinity of the compound against m-AcChR subtype Muscarinic acetylcholine receptor M3 of rat sabmandibular glands


J Med Chem 35: 1915-20 (1992)


Article DOI: 10.1021/jm00088a029
BindingDB Entry DOI: 10.7270/Q2ZS2VF5
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50006247
PNG
(CHEMBL59085 | Trimethyl-(5-methyl-4-oxo-tetrahydro...)
Show SMILES C[C@H]1O[C@H](C[N+](C)(C)C)CC1=O
Show InChI InChI=1S/C9H18NO2/c1-7-9(11)5-8(12-7)6-10(2,3)4/h7-8H,5-6H2,1-4H3/q+1/t7-,8+/m1/s1
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PubMed
4.20E+4n/an/an/an/an/an/an/an/a



Istituto Chimico-Farmaceutico dell'Università

Curated by ChEMBL


Assay Description
Binding affinity of the compound against m-AcChR subtype M1 of rat cerebral cortex.


J Med Chem 35: 1915-20 (1992)


Article DOI: 10.1021/jm00088a029
BindingDB Entry DOI: 10.7270/Q2ZS2VF5
More data for this
Ligand-Target Pair