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SMILES: CN(CCCCCCCCN(C)CCCCCCN1CCC2(CC1)OC(=O)C(O2)(c1ccccc1)c1ccccc1)CCCCCCN1CCC2(CC1)OC(=O)C(O2)(c1ccccc1)c1ccccc1

InChI Key: InChIKey=VWEQLDJRUYNWOE-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50213288   
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 M1


(RAT)
BDBM50213288
PNG
(Spirotramine)
Show SMILES CN(CCCCCCCCN(C)CCCCCCN1CCC2(CC1)OC(=O)C(O2)(c1ccccc1)c1ccccc1)CCCCCCN1CCC2(CC1)OC(=O)C(O2)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C60H82N4O6/c1-61(43-25-7-9-27-45-63-47-37-57(38-48-63)67-55(65)59(69-57,51-29-15-11-16-30-51)52-31-17-12-18-32-52)41-23-5-3-4-6-24-42-62(2)44-26-8-10-28-46-64-49-39-58(40-50-64)68-56(66)60(70-58,53-33-19-13-20-34-53)54-35-21-14-22-36-54/h11-22,29-36H,3-10,23-28,37-50H2,1-2H3
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13n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of binding of [3H]pirenzepine to muscarinic receptor (M1) in rat cortex homogenates


Citation and Details

BindingDB Entry DOI: 10.7270/Q2ZK5JTF
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(RAT)
BDBM50213288
PNG
(Spirotramine)
Show SMILES CN(CCCCCCCCN(C)CCCCCCN1CCC2(CC1)OC(=O)C(O2)(c1ccccc1)c1ccccc1)CCCCCCN1CCC2(CC1)OC(=O)C(O2)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C60H82N4O6/c1-61(43-25-7-9-27-45-63-47-37-57(38-48-63)67-55(65)59(69-57,51-29-15-11-16-30-51)52-31-17-12-18-32-52)41-23-5-3-4-6-24-42-62(2)44-26-8-10-28-46-64-49-39-58(40-50-64)68-56(66)60(70-58,53-33-19-13-20-34-53)54-35-21-14-22-36-54/h11-22,29-36H,3-10,23-28,37-50H2,1-2H3
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537n/an/an/an/an/an/an/an/a


TBA

Assay Description
Antagonism to the H1 receptor of guinea pig ileum was determined


Citation and Details

BindingDB Entry DOI: 10.7270/Q2ZK5JTF
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(RAT)
BDBM50213288
PNG
(Spirotramine)
Show SMILES CN(CCCCCCCCN(C)CCCCCCN1CCC2(CC1)OC(=O)C(O2)(c1ccccc1)c1ccccc1)CCCCCCN1CCC2(CC1)OC(=O)C(O2)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C60H82N4O6/c1-61(43-25-7-9-27-45-63-47-37-57(38-48-63)67-55(65)59(69-57,51-29-15-11-16-30-51)52-31-17-12-18-32-52)41-23-5-3-4-6-24-42-62(2)44-26-8-10-28-46-64-49-39-58(40-50-64)68-56(66)60(70-58,53-33-19-13-20-34-53)54-35-21-14-22-36-54/h11-22,29-36H,3-10,23-28,37-50H2,1-2H3
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631n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of binding of [3H]N-methylscopolamine to muscarinic receptor (M2) in rat heart homogenates


Citation and Details

BindingDB Entry DOI: 10.7270/Q2ZK5JTF
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)
BDBM50213288
PNG
(Spirotramine)
Show SMILES CN(CCCCCCCCN(C)CCCCCCN1CCC2(CC1)OC(=O)C(O2)(c1ccccc1)c1ccccc1)CCCCCCN1CCC2(CC1)OC(=O)C(O2)(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C60H82N4O6/c1-61(43-25-7-9-27-45-63-47-37-57(38-48-63)67-55(65)59(69-57,51-29-15-11-16-30-51)52-31-17-12-18-32-52)41-23-5-3-4-6-24-42-62(2)44-26-8-10-28-46-64-49-39-58(40-50-64)68-56(66)60(70-58,53-33-19-13-20-34-53)54-35-21-14-22-36-54/h11-22,29-36H,3-10,23-28,37-50H2,1-2H3
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977n/an/an/an/an/an/an/an/a


TBA

Assay Description
Inhibition of binding of [3H]N-methylscopolamine to muscarinic receptor (M3) in rat submaxillary gland homogenates


Citation and Details

BindingDB Entry DOI: 10.7270/Q2ZK5JTF
More data for this
Ligand-Target Pair