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Compile Data Set for Download or QSAR

Found 5 hits Enz. Inhib. hit(s) with Target = 'Muscarinic acetylcholine receptor M1/M2/M3/M4/M5' and Ligand = 'BDBM50228590'   
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/M2/M3/M4/M5


(RAT)
BDBM50228590
PNG
(CHEMBL326905)
Show SMILES [H][C@@]1(CCCN1C(=O)OC(C)(C)C)C#CCN1CCCC1
Show InChI InChI=1S/C16H26N2O2/c1-16(2,3)20-15(19)18-13-7-9-14(18)8-6-12-17-10-4-5-11-17/h14H,4-5,7,9-13H2,1-3H3/t14-/m0/s1
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220n/an/an/an/an/an/an/an/a



American Cyanamid Company

Curated by ChEMBL


Assay Description
Binding activity to the muscarinic acetylcholine receptor in rat cortex, assayed using [3H]CD as a radioligand.


J Med Chem 33: 3190-8 (1990)


BindingDB Entry DOI: 10.7270/Q2M32Z0K
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50228590
PNG
(CHEMBL326905)
Show SMILES [H][C@@]1(CCCN1C(=O)OC(C)(C)C)C#CCN1CCCC1
Show InChI InChI=1S/C16H26N2O2/c1-16(2,3)20-15(19)18-13-7-9-14(18)8-6-12-17-10-4-5-11-17/h14H,4-5,7,9-13H2,1-3H3/t14-/m0/s1
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420n/an/an/an/an/an/an/an/a



American Cyanamid Company

Curated by ChEMBL


Assay Description
Competitive inhibition of recombinant TAK1-TAB1 assessed as [33P]gamma-ATP incorporation into substrate histone H1 peptide by filter plate assay


J Med Chem 33: 3190-8 (1990)


BindingDB Entry DOI: 10.7270/Q2M32Z0K
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50228590
PNG
(CHEMBL326905)
Show SMILES [H][C@@]1(CCCN1C(=O)OC(C)(C)C)C#CCN1CCCC1
Show InChI InChI=1S/C16H26N2O2/c1-16(2,3)20-15(19)18-13-7-9-14(18)8-6-12-17-10-4-5-11-17/h14H,4-5,7,9-13H2,1-3H3/t14-/m0/s1
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660n/an/an/an/an/an/an/an/a



American Cyanamid Company

Curated by ChEMBL


Assay Description
Binding activity against Muscarinic acetylcholine receptor in rat cortex, using [3H]QNB as a radioligand.


J Med Chem 33: 3190-8 (1990)


BindingDB Entry DOI: 10.7270/Q2M32Z0K
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50228590
PNG
(CHEMBL326905)
Show SMILES [H][C@@]1(CCCN1C(=O)OC(C)(C)C)C#CCN1CCCC1
Show InChI InChI=1S/C16H26N2O2/c1-16(2,3)20-15(19)18-13-7-9-14(18)8-6-12-17-10-4-5-11-17/h14H,4-5,7,9-13H2,1-3H3/t14-/m0/s1
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960n/an/an/an/an/an/an/an/a



American Cyanamid Company

Curated by ChEMBL


Assay Description
Binding activity to muscarinic acetylcholine receptor in rat heart, assayed using [3H]QNB as a radioligand in the presence of Gpp(NH)p.


J Med Chem 33: 3190-8 (1990)


BindingDB Entry DOI: 10.7270/Q2M32Z0K
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50228590
PNG
(CHEMBL326905)
Show SMILES [H][C@@]1(CCCN1C(=O)OC(C)(C)C)C#CCN1CCCC1
Show InChI InChI=1S/C16H26N2O2/c1-16(2,3)20-15(19)18-13-7-9-14(18)8-6-12-17-10-4-5-11-17/h14H,4-5,7,9-13H2,1-3H3/t14-/m0/s1
PDB
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PubMed
1.32E+3n/an/an/an/an/an/an/an/a



American Cyanamid Company

Curated by ChEMBL


Assay Description
Binding activity to muscarinic acetylcholine receptor in rat heart, assayed using [3H]-QNB as a radioligand.


J Med Chem 33: 3190-8 (1990)


BindingDB Entry DOI: 10.7270/Q2M32Z0K
More data for this
Ligand-Target Pair