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PubMed code 3712371

Compile data set for download or QSAR
Found 49 hits of Enzyme Inhibition Constant Data   
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)
BDBM50024979
PNG
(3-Ethoxy-5-methyl-4,5,6,7-tetrahydro-isoxazolo[4,5...)
Show SMILES CCOc1noc2CC[NH+](C)Cc12
Show InChI InChI=1S/C9H14N2O2/c1-3-12-9-7-6-11(2)5-4-8(7)13-10-9/h3-6H2,1-2H3/p+1
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n/an/a 2.40E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Angiotensin I converting enzyme activity at pH 8.5 in rabbit lung


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024992
PNG
(3-Isopropoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]py...)
Show SMILES CC(C)Oc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C9H14N2O2/c1-6(2)12-9-7-5-10-4-3-8(7)13-11-9/h6,10H,3-5H2,1-2H3/p+1
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n/an/a 3.50E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Angiotensin I converting enzyme activity at pH 8.5 in rabbit lung


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024980
PNG
(3-But-2-ynyloxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c...)
Show SMILES CC#CCOc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C10H12N2O2/c1-2-3-6-13-10-8-7-11-5-4-9(8)14-12-10/h11H,4-7H2,1H3/p+1
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n/an/a 5.20E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of binding of radioactive N-propylbenzilycholine mustard ([3H]-PrBCM) to rat brain membranes


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM46858
PNG
(1-methyl-3,6-dihydro-2H-pyridine-5-carboxylic acid...)
Show SMILES COC(=O)C1=CCCN(C)C1 |t:4|
Show InChI InChI=1S/C8H13NO2/c1-9-5-3-4-7(6-9)8(10)11-2/h4H,3,5-6H2,1-2H3
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n/an/a 5.60E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of solubilized, purified rat liver HMG-CoA reductase.


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024995
PNG
(3-Prop-2-ynyloxy-4,5,6,7-tetrahydro-isoxazolo[4,5-...)
Show SMILES C#CCOc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C9H10N2O2/c1-2-5-12-9-7-6-10-4-3-8(7)13-11-9/h1,10H,3-6H2/p+1
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n/an/a 5.80E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Angiotensin I converting enzyme activity in rabbit lung


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024993
PNG
(3-Ethoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyridi...)
Show SMILES CCOc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C8H12N2O2/c1-2-11-8-6-5-9-4-3-7(6)12-10-8/h9H,2-5H2,1H3/p+1
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n/an/a 6.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of solubilized, purified rat liver HMG-CoA reductase.


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50004656
PNG
((2-Carbamoyloxy-ethyl)-trimethyl-ammonium | (2-Car...)
Show SMILES C[N+](C)(C)CCOC(N)=O
Show InChI InChI=1S/C6H14N2O2/c1-8(2,3)4-5-10-6(7)9/h4-5H2,1-3H3,(H-,7,9)/p+1
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n/an/a 9.00E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of solubilized, purified rat liver HMG-CoA reductase.


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024985
PNG
(3-Allyloxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyri...)
Show SMILES C=CCOc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C9H12N2O2/c1-2-5-12-9-7-6-10-4-3-8(7)13-11-9/h2,10H,1,3-6H2/p+1
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n/an/a 9.60E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Angiotensin I converting enzyme activity in rabbit lung


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024990
PNG
(3-Propoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyrid...)
Show SMILES CCCOc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C9H14N2O2/c1-2-5-12-9-7-6-10-4-3-8(7)13-11-9/h10H,2-6H2,1H3/p+1
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n/an/a 1.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Angiotensin I converting enzyme activity in rabbit lung


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(Homo sapiens (Human))
BDBM50024992
PNG
(3-Isopropoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]py...)
Show SMILES CC(C)Oc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C9H14N2O2/c1-6(2)12-9-7-5-10-4-3-8(7)13-11-9/h6,10H,3-5H2,1-2H3/p+1
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n/an/a 1.10E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro antagonistic activity against peripheral Muscarinic acetylcholine receptor in guinea pig ileum as inhibition of acetylcholine induced muscle...


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024989
PNG
(3-(2-Bromo-allyloxy)-4,5,6,7-tetrahydro-isoxazolo[...)
Show SMILES BrC(=C)COc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C9H11BrN2O2/c1-6(10)5-13-9-7-4-11-3-2-8(7)14-12-9/h11H,1-5H2/p+1
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n/an/a 1.30E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Angiotensin I converting enzyme activity in rabbit lung


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024981
PNG
(3-But-2-enyloxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c...)
Show SMILES C\C=C\COc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C10H14N2O2/c1-2-3-6-13-10-8-7-11-5-4-9(8)14-12-10/h2-3,11H,4-7H2,1H3/p+1/b3-2+
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n/an/a 1.40E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Angiotensin I converting enzyme activity in rabbit lung


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024987
PNG
(3-Butoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyridi...)
Show SMILES CCCCOc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C10H16N2O2/c1-2-3-6-13-10-8-7-11-5-4-9(8)14-12-10/h11H,2-7H2,1H3/p+1
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n/an/a 1.50E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of binding of radioactive N-propylbenzilycholine mustard ([3H]-PrBCM) to rat brain membranes


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024991
PNG
(5-Ethyl-3-methoxy-4,5,6,7-tetrahydro-isoxazolo[4,5...)
Show SMILES CC[NH+]1CCc2onc(OC)c2C1
Show InChI InChI=1S/C9H14N2O2/c1-3-11-5-4-8-7(6-11)9(12-2)10-13-8/h3-6H2,1-2H3/p+1
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n/an/a 1.50E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Angiotensin I converting enzyme activity at pH 8.5 in rabbit lung


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(Homo sapiens (Human))
BDBM50024989
PNG
(3-(2-Bromo-allyloxy)-4,5,6,7-tetrahydro-isoxazolo[...)
Show SMILES BrC(=C)COc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C9H11BrN2O2/c1-6(10)5-13-9-7-4-11-3-2-8(7)14-12-9/h11H,1-5H2/p+1
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n/an/a 2.20E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro antagonistic activity against peripheral Muscarinic acetylcholine receptor in guinea pig ileum as inhibition of acetylcholine induced muscle...


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024996
PNG
(3-Methoxy-5-methyl-4,5,6,7-tetrahydro-isoxazolo[4,...)
Show SMILES COc1noc2CC[NH+](C)Cc12
Show InChI InChI=1S/C8H12N2O2/c1-10-4-3-7-6(5-10)8(11-2)9-12-7/h3-5H2,1-2H3/p+1
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n/an/a 2.70E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of binding of radioactive N-propylbenzilycholine mustard ([3H]-PrBCM) to rat brain membranes


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024984
PNG
(1,2,5,6-Tetrahydro-pyridine-3-carboxylic acid meth...)
Show SMILES COC(=O)C1=CCCNC1 |t:4|
Show InChI InChI=1S/C7H11NO2/c1-10-7(9)6-3-2-4-8-5-6/h3,8H,2,4-5H2,1H3
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n/an/a 3.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Angiotensin I converting enzyme activity in rabbit lung


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024983
PNG
(3-Benzyloxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyr...)
Show SMILES C(Oc1noc2CC[NH2+]Cc12)c1ccccc1
Show InChI InChI=1S/C13H14N2O2/c1-2-4-10(5-3-1)9-16-13-11-8-14-7-6-12(11)17-15-13/h1-5,14H,6-9H2/p+1
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n/an/a 3.20E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Angiotensin I converting enzyme activity at pH 8.5 in rabbit lung


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(Homo sapiens (Human))
BDBM50024990
PNG
(3-Propoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyrid...)
Show SMILES CCCOc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C9H14N2O2/c1-2-5-12-9-7-6-10-4-3-8(7)13-11-9/h10H,2-6H2,1H3/p+1
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n/an/a 3.50E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro antagonistic activity against peripheral Muscarinic acetylcholine receptor in guinea pig ileum as inhibition of acetylcholine induced muscle...


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024988
PNG
(3-Methoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyrid...)
Show SMILES COc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C7H10N2O2/c1-10-7-5-4-8-3-2-6(5)11-9-7/h8H,2-4H2,1H3/p+1
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n/an/a 4.50E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of binding of radioactive N-propylbenzilycholine mustard ([3H]-PrBCM) to rat brain membranes


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(Homo sapiens (Human))
BDBM50024983
PNG
(3-Benzyloxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyr...)
Show SMILES C(Oc1noc2CC[NH2+]Cc12)c1ccccc1
Show InChI InChI=1S/C13H14N2O2/c1-2-4-10(5-3-1)9-16-13-11-8-14-7-6-12(11)17-15-13/h1-5,14H,6-9H2/p+1
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n/an/a 4.80E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro antagonistic activity against peripheral Muscarinic acetylcholine receptor in guinea pig ileum as inhibition of acetylcholine induced muscle...


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(Homo sapiens (Human))
BDBM50024994
PNG
(3-Isobutoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyr...)
Show SMILES CC(C)COc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C10H16N2O2/c1-7(2)6-13-10-8-5-11-4-3-9(8)14-12-10/h7,11H,3-6H2,1-2H3/p+1
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n/an/a 4.90E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Angiotensin I converting enzyme activity in rabbit lung


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024986
PNG
(5-Benzyl-3-methoxy-4,5,6,7-tetrahydro-isoxazolo[4,...)
Show SMILES COc1noc2CC[NH+](Cc3ccccc3)Cc12
Show InChI InChI=1S/C14H16N2O2/c1-17-14-12-10-16(8-7-13(12)18-15-14)9-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3/p+1
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n/an/a>5.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of solubilized, purified rat liver HMG-CoA reductase.


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024982
PNG
(3-Hydroxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyrid...)
Show SMILES O=c1[nH]oc2CC[NH2+]Cc12
Show InChI InChI=1S/C6H8N2O2/c9-6-4-3-7-2-1-5(4)10-8-6/h7H,1-3H2,(H,8,9)/p+1
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n/an/a>5.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Angiotensin I converting enzyme activity in rabbit lung


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(RAT)
BDBM50024994
PNG
(3-Isobutoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyr...)
Show SMILES CC(C)COc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C10H16N2O2/c1-7(2)6-13-10-8-5-11-4-3-9(8)14-12-10/h7,11H,3-6H2,1-2H3/p+1
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n/an/a>5.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of binding of radioactive N-propylbenzilycholine mustard ([3H]-PrBCM) to rat brain membranes


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(Homo sapiens (Human))
BDBM50024986
PNG
(5-Benzyl-3-methoxy-4,5,6,7-tetrahydro-isoxazolo[4,...)
Show SMILES COc1noc2CC[NH+](Cc3ccccc3)Cc12
Show InChI InChI=1S/C14H16N2O2/c1-17-14-12-10-16(8-7-13(12)18-15-14)9-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3/p+1
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n/an/a>5.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro antagonistic activity against peripheral Muscarinic acetylcholine receptor in guinea pig ileum as inhibition of acetylcholine induced muscle...


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(Homo sapiens (Human))
BDBM50024987
PNG
(3-Butoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyridi...)
Show SMILES CCCCOc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C10H16N2O2/c1-2-3-6-13-10-8-7-11-5-4-9(8)14-12-10/h11H,2-7H2,1H3/p+1
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n/an/a>5.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Angiotensin I converting enzyme activity in rabbit lung


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(Homo sapiens (Human))
BDBM50024981
PNG
(3-But-2-enyloxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c...)
Show SMILES C\C=C\COc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C10H14N2O2/c1-2-3-6-13-10-8-7-11-5-4-9(8)14-12-10/h2-3,11H,4-7H2,1H3/p+1/b3-2+
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n/an/a>5.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibition of Angiotensin I converting enzyme activity in rabbit lung


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1/M2/M3/M4/M5


(Homo sapiens (Human))
BDBM50024982
PNG
(3-Hydroxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyrid...)
Show SMILES O=c1[nH]oc2CC[NH2+]Cc12
Show InChI InChI=1S/C6H8N2O2/c9-6-4-3-7-2-1-5(4)10-8-6/h7H,1-3H2,(H,8,9)/p+1
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n/an/a>5.00E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro antagonistic activity against peripheral Muscarinic acetylcholine receptor in guinea pig ileum as inhibition of acetylcholine induced muscle...


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024983
PNG
(3-Benzyloxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyr...)
Show SMILES C(Oc1noc2CC[NH2+]Cc12)c1ccccc1
Show InChI InChI=1S/C13H14N2O2/c1-2-4-10(5-3-1)9-16-13-11-8-14-7-6-12(11)17-15-13/h1-5,14H,6-9H2/p+1
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n/an/an/an/a>5.00E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024991
PNG
(5-Ethyl-3-methoxy-4,5,6,7-tetrahydro-isoxazolo[4,5...)
Show SMILES CC[NH+]1CCc2onc(OC)c2C1
Show InChI InChI=1S/C9H14N2O2/c1-3-11-5-4-8-7(6-11)9(12-2)10-13-8/h3-6H2,1-2H3/p+1
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n/an/an/an/a 2.00E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024986
PNG
(5-Benzyl-3-methoxy-4,5,6,7-tetrahydro-isoxazolo[4,...)
Show SMILES COc1noc2CC[NH+](Cc3ccccc3)Cc12
Show InChI InChI=1S/C14H16N2O2/c1-17-14-12-10-16(8-7-13(12)18-15-14)9-11-5-3-2-4-6-11/h2-6H,7-10H2,1H3/p+1
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n/an/an/an/a>5.00E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024996
PNG
(3-Methoxy-5-methyl-4,5,6,7-tetrahydro-isoxazolo[4,...)
Show SMILES COc1noc2CC[NH+](C)Cc12
Show InChI InChI=1S/C8H12N2O2/c1-10-4-3-7-6(5-10)8(11-2)9-12-7/h3-5H2,1-2H3/p+1
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n/an/an/an/a 800n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024990
PNG
(3-Propoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyrid...)
Show SMILES CCCOc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C9H14N2O2/c1-2-5-12-9-7-6-10-4-3-8(7)13-11-9/h10H,2-6H2,1H3/p+1
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n/an/an/an/a>5.00E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024979
PNG
(3-Ethoxy-5-methyl-4,5,6,7-tetrahydro-isoxazolo[4,5...)
Show SMILES CCOc1noc2CC[NH+](C)Cc12
Show InChI InChI=1S/C9H14N2O2/c1-3-12-9-7-6-11(2)5-4-8(7)13-10-9/h3-6H2,1-2H3/p+1
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n/an/an/an/a 1.60E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024989
PNG
(3-(2-Bromo-allyloxy)-4,5,6,7-tetrahydro-isoxazolo[...)
Show SMILES BrC(=C)COc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C9H11BrN2O2/c1-6(10)5-13-9-7-4-11-3-2-8(7)14-12-9/h11H,1-5H2/p+1
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n/an/an/an/a>5.00E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50004656
PNG
((2-Carbamoyloxy-ethyl)-trimethyl-ammonium | (2-Car...)
Show SMILES C[N+](C)(C)CCOC(N)=O
Show InChI InChI=1S/C6H14N2O2/c1-8(2,3)4-5-10-6(7)9/h4-5H2,1-3H3,(H-,7,9)/p+1
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n/an/an/an/a 70n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM46858
PNG
(1-methyl-3,6-dihydro-2H-pyridine-5-carboxylic acid...)
Show SMILES COC(=O)C1=CCCN(C)C1 |t:4|
Show InChI InChI=1S/C8H13NO2/c1-9-5-3-4-7(6-9)8(10)11-2/h4H,3,5-6H2,1-2H3
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n/an/an/an/a 100n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024981
PNG
(3-But-2-enyloxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c...)
Show SMILES C\C=C\COc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C10H14N2O2/c1-2-3-6-13-10-8-7-11-5-4-9(8)14-12-10/h2-3,11H,4-7H2,1H3/p+1/b3-2+
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n/an/an/an/a>5.00E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024985
PNG
(3-Allyloxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyri...)
Show SMILES C=CCOc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C9H12N2O2/c1-2-5-12-9-7-6-10-4-3-8(7)13-11-9/h2,10H,1,3-6H2/p+1
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n/an/an/an/a 1.30E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024988
PNG
(3-Methoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyrid...)
Show SMILES COc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C7H10N2O2/c1-10-7-5-4-8-3-2-6(5)11-9-7/h8H,2-4H2,1H3/p+1
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n/an/an/an/a 1.80E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024982
PNG
(3-Hydroxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyrid...)
Show SMILES O=c1[nH]oc2CC[NH2+]Cc12
Show InChI InChI=1S/C6H8N2O2/c9-6-4-3-7-2-1-5(4)10-8-6/h7H,1-3H2,(H,8,9)/p+1
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n/an/an/an/a>5.00E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024992
PNG
(3-Isopropoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]py...)
Show SMILES CC(C)Oc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C9H14N2O2/c1-6(2)12-9-7-5-10-4-3-8(7)13-11-9/h6,10H,3-5H2,1-2H3/p+1
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n/an/an/an/a>5.00E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024995
PNG
(3-Prop-2-ynyloxy-4,5,6,7-tetrahydro-isoxazolo[4,5-...)
Show SMILES C#CCOc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C9H10N2O2/c1-2-5-12-9-7-6-10-4-3-8(7)13-11-9/h1,10H,3-6H2/p+1
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n/an/an/an/a 1.20E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024987
PNG
(3-Butoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyridi...)
Show SMILES CCCCOc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C10H16N2O2/c1-2-3-6-13-10-8-7-11-5-4-9(8)14-12-10/h11H,2-7H2,1H3/p+1
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n/an/an/an/a>5.00E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024993
PNG
(3-Ethoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyridi...)
Show SMILES CCOc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C8H12N2O2/c1-2-11-8-6-5-9-4-3-7(6)12-10-8/h9H,2-5H2,1H3/p+1
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n/an/an/an/a 3.40E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024980
PNG
(3-But-2-ynyloxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c...)
Show SMILES CC#CCOc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C10H12N2O2/c1-2-3-6-13-10-8-7-11-5-4-9(8)14-12-10/h11H,4-7H2,1H3/p+1
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n/an/an/an/a 4.50E+3n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024994
PNG
(3-Isobutoxy-4,5,6,7-tetrahydro-isoxazolo[4,5-c]pyr...)
Show SMILES CC(C)COc1noc2CC[NH2+]Cc12
Show InChI InChI=1S/C10H16N2O2/c1-7(2)6-13-10-8-5-11-4-3-9(8)14-12-10/h7,11H,3-6H2,1-2H3/p+1
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n/an/an/an/a>5.00E+4n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50024984
PNG
(1,2,5,6-Tetrahydro-pyridine-3-carboxylic acid meth...)
Show SMILES COC(=O)C1=CCCNC1 |t:4|
Show InChI InChI=1S/C7H11NO2/c1-10-7(9)6-3-2-4-8-5-6/h3,8H,2,4-5H2,1H3
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n/an/an/an/a 300n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Contraction of guinea pig ileum by muscarinic AChR activation, which could be inhibited by application of atropine


J Med Chem 29: 1004-9 (1986)


BindingDB Entry DOI: 10.7270/Q2XP73XW
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%