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Compile Data Set for Download or QSAR

Found 937 hits with Last Name = 'bøgesø' and Initial = 'kp'   
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
Dopamine D2 receptor/Serotonin 2 (5-HT2) receptor


(Rattus norvegicus (rat))
BDBM50041020
PNG
(4-(3-Bromo-dibenzo[a,d]cyclohepten-5-ylidene)-1-me...)
Show SMILES CN1CCC(CC1)=C1c2ccccc2C=Cc2ccc(Br)cc12
Show InChI InChI=1S/C21H20BrN/c1-23-12-10-17(11-13-23)21-19-5-3-2-4-15(19)6-7-16-8-9-18(22)14-20(16)21/h2-9,14H,10-13H2,1H3
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4n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Binding affinity at dopamine D2 receptor by [3H]-Spiperone displacement.


J Med Chem 37: 950-62 (1994)


Article DOI: 10.1021/jm00033a013
BindingDB Entry DOI: 10.7270/Q2GF0SKK
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038220
PNG
(5-(2-Allyl-2H-[1,2,3]triazol-4-yl)-1-methyl-1,2,3,...)
Show SMILES CN1CCC=C(C1)c1cnn(CC=C)n1
Show InChI InChI=1S/C11H16N4/c1-3-6-15-12-8-11(13-15)10-5-4-7-14(2)9-10/h3,5,8H,1,4,6-7,9H2,2H3
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6.30n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038236
PNG
(1-Methyl-5-(2-prop-2-ynyl-2H-[1,2,3]triazol-4-yl)-...)
Show SMILES CN1CCC=C(C1)c1cnn(CC#C)n1
Show InChI InChI=1S/C11H14N4/c1-3-6-15-12-8-11(13-15)10-5-4-7-14(2)9-10/h1,5,8H,4,6-7,9H2,2H3
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7.70n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038227
PNG
(5-(2-Butyl-2H-[1,2,3]triazol-4-yl)-1-methyl-1,2,3,...)
Show SMILES CCCCn1ncc(n1)C1=CCCN(C)C1
Show InChI InChI=1S/C12H20N4/c1-3-4-8-16-13-9-12(14-16)11-6-5-7-15(2)10-11/h6,9H,3-5,7-8,10H2,1-2H3
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13n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038232
PNG
(1-Methyl-5-(2-propyl-2H-[1,2,3]triazol-4-yl)-1,2,3...)
Show SMILES CCCn1ncc(n1)C1=CCCN(C)C1
Show InChI InChI=1S/C11H18N4/c1-3-6-15-12-8-11(13-15)10-5-4-7-14(2)9-10/h5,8H,3-4,6-7,9H2,1-2H3
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15n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038242
PNG
(5-(2-Allyl-2H-tetrazol-5-yl)-1-methyl-1,2,3,6-tetr...)
Show SMILES CN1CCC=C(C1)c1nnn(CC=C)n1
Show InChI InChI=1S/C10H15N5/c1-3-6-15-12-10(11-13-15)9-5-4-7-14(2)8-9/h3,5H,1,4,6-8H2,2H3
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21n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038224
PNG
(5-(2-Ethyl-2H-[1,2,3]triazol-4-yl)-1-methyl-1,2,3,...)
Show SMILES CCn1ncc(n1)C1=CCCN(C)C1
Show InChI InChI=1S/C10H16N4/c1-3-14-11-7-10(12-14)9-5-4-6-13(2)8-9/h5,7H,3-4,6,8H2,1-2H3
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24n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038221
PNG
(1-Methyl-5-(2-pentyl-2H-tetrazol-5-yl)-1,2,3,6-tet...)
Show SMILES CCCCCn1nnc(n1)C1=CCCN(C)C1
Show InChI InChI=1S/C12H21N5/c1-3-4-5-9-17-14-12(13-15-17)11-7-6-8-16(2)10-11/h7H,3-6,8-10H2,1-2H3
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26n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038239
PNG
(1-Methyl-5-(2-octyl-2H-tetrazol-5-yl)-1,2,3,6-tetr...)
Show SMILES CCCCCCCCn1nnc(n1)C1=CCCN(C)C1
Show InChI InChI=1S/C15H27N5/c1-3-4-5-6-7-8-12-20-17-15(16-18-20)14-10-9-11-19(2)13-14/h10H,3-9,11-13H2,1-2H3
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27n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038251
PNG
(3-Methyl-5-(2-prop-2-ynyl-2H-[1,2,3]triazol-4-yl)-...)
Show SMILES CC1CNCC(=C1)c1cnn(CC#C)n1
Show InChI InChI=1/C11H14N4/c1-3-4-15-13-8-11(14-15)10-5-9(2)6-12-7-10/h1,5,8-9,12H,4,6-7H2,2H3
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30n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038241
PNG
(5-(2-Hexyl-2H-tetrazol-5-yl)-1-methyl-1,2,3,6-tetr...)
Show SMILES CCCCCCn1nnc(n1)C1=CCCN(C)C1
Show InChI InChI=1S/C13H23N5/c1-3-4-5-6-10-18-15-13(14-16-18)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3
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32n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038219
PNG
(1-Methyl-5-(2-methyl-2H-[1,2,3]triazol-4-yl)-1,2,3...)
Show SMILES CN1CCC=C(C1)c1cnn(C)n1
Show InChI InChI=1S/C9H14N4/c1-12-5-3-4-8(7-12)9-6-10-13(2)11-9/h4,6H,3,5,7H2,1-2H3
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35n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038210
PNG
(5-(2-Ethyl-2H-tetrazol-5-yl)-1-methyl-1,2,3,6-tetr...)
Show SMILES CCn1nnc(n1)C1=CCCN(C)C1
Show InChI InChI=1S/C9H15N5/c1-3-14-11-9(10-12-14)8-5-4-6-13(2)7-8/h5H,3-4,6-7H2,1-2H3
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36n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038237
PNG
(5-(2-Heptyl-2H-tetrazol-5-yl)-1-methyl-1,2,3,6-tet...)
Show SMILES CCCCCCCn1nnc(n1)C1=CCCN(C)C1
Show InChI InChI=1S/C14H25N5/c1-3-4-5-6-7-11-19-16-14(15-17-19)13-9-8-10-18(2)12-13/h9H,3-8,10-12H2,1-2H3
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37n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038215
PNG
(5-(2-Butyl-2H-tetrazol-5-yl)-1-methyl-1,2,3,6-tetr...)
Show SMILES CCCCn1nnc(n1)C1=CCCN(C)C1
Show InChI InChI=1S/C11H19N5/c1-3-4-8-16-13-11(12-14-16)10-6-5-7-15(2)9-10/h6H,3-5,7-9H2,1-2H3
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37n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038253
PNG
(1-Methyl-5-(2-vinyl-2H-[1,2,3]triazol-4-yl)-1,2,3,...)
Show SMILES CN1CCC=C(C1)c1cnn(C=C)n1
Show InChI InChI=1S/C10H14N4/c1-3-14-11-7-10(12-14)9-5-4-6-13(2)8-9/h3,5,7H,1,4,6,8H2,2H3
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40n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038225
PNG
(1-Methyl-5-(2-prop-2-ynyl-2H-tetrazol-5-yl)-1,2,3,...)
Show SMILES CN1CCC=C(C1)c1nnn(CC#C)n1
Show InChI InChI=1S/C10H13N5/c1-3-6-15-12-10(11-13-15)9-5-4-7-14(2)8-9/h1,5H,4,6-8H2,2H3
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44n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038216
PNG
(1-Methyl-5-(2-propyl-2H-tetrazol-5-yl)-1,2,3,6-tet...)
Show SMILES CCCn1nnc(n1)C1=CCCN(C)C1
Show InChI InChI=1S/C10H17N5/c1-3-6-15-12-10(11-13-15)9-5-4-7-14(2)8-9/h5H,3-4,6-8H2,1-2H3
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57n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038252
PNG
(5-(2-Propyl-2H-[1,2,3]triazol-4-yl)-1,2,3,6-tetrah...)
Show SMILES CCCn1ncc(n1)C1=CCCNC1
Show InChI InChI=1S/C10H16N4/c1-2-6-14-12-8-10(13-14)9-4-3-5-11-7-9/h4,8,11H,2-3,5-7H2,1H3
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77n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038217
PNG
(3-(2-Prop-2-ynyl-2H-[1,2,3]triazol-4-yl)-piperidin...)
Show SMILES C#CCn1ncc(n1)C1CCCNC1
Show InChI InChI=1/C10H14N4/c1-2-6-14-12-8-10(13-14)9-4-3-5-11-7-9/h1,8-9,11H,3-7H2
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84n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038223
PNG
(5-(2-Isopropyl-2H-tetrazol-5-yl)-1-methyl-1,2,3,6-...)
Show SMILES CC(C)n1nnc(n1)C1=CCCN(C)C1
Show InChI InChI=1S/C10H17N5/c1-8(2)15-12-10(11-13-15)9-5-4-6-14(3)7-9/h5,8H,4,6-7H2,1-3H3
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84n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038245
PNG
(5-(2-Butyl-2H-[1,2,3]triazol-4-yl)-1,2,3,6-tetrahy...)
Show SMILES CCCCn1ncc(n1)C1=CCCNC1
Show InChI InChI=1S/C11H18N4/c1-2-3-7-15-13-9-11(14-15)10-5-4-6-12-8-10/h5,9,12H,2-4,6-8H2,1H3
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100n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038235
PNG
(5-(2-Ethyl-2H-[1,2,3]triazol-4-yl)-1,2,3,6-tetrahy...)
Show SMILES CCn1ncc(n1)C1=CCCNC1
Show InChI InChI=1S/C9H14N4/c1-2-13-11-7-9(12-13)8-4-3-5-10-6-8/h4,7,10H,2-3,5-6H2,1H3
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120n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038218
PNG
(1-Methyl-5-(2-vinyl-2H-tetrazol-5-yl)-1,2,3,6-tetr...)
Show SMILES CN1CCC=C(C1)c1nnn(C=C)n1
Show InChI InChI=1S/C9H13N5/c1-3-14-11-9(10-12-14)8-5-4-6-13(2)7-8/h3,5H,1,4,6-7H2,2H3
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120n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038217
PNG
(3-(2-Prop-2-ynyl-2H-[1,2,3]triazol-4-yl)-piperidin...)
Show SMILES C#CCn1ncc(n1)C1CCCNC1
Show InChI InChI=1/C10H14N4/c1-2-6-14-12-8-10(13-14)9-4-3-5-11-7-9/h1,8-9,11H,3-7H2
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140n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038214
PNG
(1-Ethyl-5-(2-ethyl-2H-tetrazol-5-yl)-1,2,3,6-tetra...)
Show SMILES CCN1CCC=C(C1)c1nnn(CC)n1
Show InChI InChI=1S/C10H17N5/c1-3-14-7-5-6-9(8-14)10-11-13-15(4-2)12-10/h6H,3-5,7-8H2,1-2H3
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140n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038213
PNG
(3-(2-Allyl-2H-[1,2,3]triazol-4-yl)-piperidine | CH...)
Show SMILES C=CCn1ncc(n1)C1CCCNC1
Show InChI InChI=1/C10H16N4/c1-2-6-14-12-8-10(13-14)9-4-3-5-11-7-9/h2,8-9,11H,1,3-7H2
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170n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038213
PNG
(3-(2-Allyl-2H-[1,2,3]triazol-4-yl)-piperidine | CH...)
Show SMILES C=CCn1ncc(n1)C1CCCNC1
Show InChI InChI=1/C10H16N4/c1-2-6-14-12-8-10(13-14)9-4-3-5-11-7-9/h2,8-9,11H,1,3-7H2
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170n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038250
PNG
(3-Methyl-5-(2-methyl-2H-tetrazol-5-yl)-1,2,3,6-tet...)
Show SMILES CC1CNCC(=C1)c1nnn(C)n1
Show InChI InChI=1/C8H13N5/c1-6-3-7(5-9-4-6)8-10-12-13(2)11-8/h3,6,9H,4-5H2,1-2H3
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180n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038244
PNG
(1-Methyl-5-(2-methyl-2H-tetrazol-5-yl)-1,2,3,6-tet...)
Show SMILES CN1CCC=C(C1)c1nnn(C)n1
Show InChI InChI=1S/C8H13N5/c1-12-5-3-4-7(6-12)8-9-11-13(2)10-8/h4H,3,5-6H2,1-2H3
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250n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038246
PNG
(3-(2-Ethyl-2H-[1,2,3]triazol-4-yl)-piperidine | CH...)
Show SMILES CCn1ncc(n1)C1CCCNC1
Show InChI InChI=1/C9H16N4/c1-2-13-11-7-9(12-13)8-4-3-5-10-6-8/h7-8,10H,2-6H2,1H3
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260n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038247
PNG
(3-(2-Prop-2-ynyl-2H-tetrazol-5-yl)-piperidine | CH...)
Show SMILES C#CCn1nnc(n1)C1CCCNC1
Show InChI InChI=1/C9H13N5/c1-2-6-14-12-9(11-13-14)8-4-3-5-10-7-8/h1,8,10H,3-7H2
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260n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038248
PNG
(5-(2-Ethyl-2H-tetrazol-5-yl)-1-isopropyl-1,2,3,6-t...)
Show SMILES CCn1nnc(n1)C1=CCCN(C1)C(C)C
Show InChI InChI=1S/C11H19N5/c1-4-16-13-11(12-14-16)10-6-5-7-15(8-10)9(2)3/h6,9H,4-5,7-8H2,1-3H3
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270n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038212
PNG
(2-Ethyl-8-methyl-2,8-diaza-spiro[4.5]decane-1,3-di...)
Show SMILES CCN1C(=O)CC2(CCN(C)CC2)C1=O
Show InChI InChI=1S/C11H18N2O2/c1-3-13-9(14)8-11(10(13)15)4-6-12(2)7-5-11/h3-8H2,1-2H3
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400n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038234
PNG
(5-(2-Methyl-2H-[1,2,3]triazol-4-yl)-1,2,3,6-tetrah...)
Show SMILES Cn1ncc(n1)C1=CCCNC1
Show InChI InChI=1S/C8H12N4/c1-12-10-6-8(11-12)7-3-2-4-9-5-7/h3,6,9H,2,4-5H2,1H3
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500n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50006584
PNG
((McN-A-343) [4-(3-Chloro-phenylcarbamoyloxy)-but-2...)
Show SMILES C[N+](C)(C)CC#CCOC(=O)Nc1cccc(Cl)c1
Show InChI InChI=1S/C14H17ClN2O2/c1-17(2,3)9-4-5-10-19-14(18)16-13-8-6-7-12(15)11-13/h6-8,11H,9-10H2,1-3H3/p+1
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600n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(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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640n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038211
PNG
(5-(1-Ethyl-1H-[1,2,3]triazol-4-yl)-1-methyl-1,2,3,...)
Show SMILES CCn1cc(nn1)C1=CCCN(C)C1
Show InChI InChI=1S/C10H16N4/c1-3-14-8-10(11-12-14)9-5-4-6-13(2)7-9/h5,8H,3-4,6-7H2,1-2H3
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770n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038230
PNG
(2-Methyl-5-(2-methyl-2H-tetrazol-5-yl)-1,2,3,6-tet...)
Show SMILES CC1CC=C(CN1)c1nnn(C)n1
Show InChI InChI=1/C8H13N5/c1-6-3-4-7(5-9-6)8-10-12-13(2)11-8/h4,6,9H,3,5H2,1-2H3
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900n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038249
PNG
(5-(2-Ethyl-2H-tetrazol-5-yl)-1-propyl-1,2,3,6-tetr...)
Show SMILES CCCN1CCC=C(C1)c1nnn(CC)n1
Show InChI InChI=1S/C11H19N5/c1-3-7-15-8-5-6-10(9-15)11-12-14-16(4-2)13-11/h6H,3-5,7-9H2,1-2H3
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900n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038226
PNG
(5-(2-Ethyl-2H-tetrazol-5-yl)-1,2,3,6-tetrahydro-py...)
Show SMILES CCn1nnc(n1)C1=CCCNC1
Show InChI InChI=1S/C8H13N5/c1-2-13-11-8(10-12-13)7-4-3-5-9-6-7/h4,9H,2-3,5-6H2,1H3
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960n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038228
PNG
(4-Methyl-5-(2-methyl-2H-tetrazol-5-yl)-1,2,3,6-tet...)
Show SMILES CC1=C(CNCC1)c1nnn(C)n1
Show InChI InChI=1S/C8H13N5/c1-6-3-4-9-5-7(6)8-10-12-13(2)11-8/h9H,3-5H2,1-2H3
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960n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038243
PNG
(3-(2-Ethyl-2H-tetrazol-5-yl)-piperidine | CHEMBL13...)
Show SMILES CCn1nnc(n1)C1CCCNC1
Show InChI InChI=1/C8H15N5/c1-2-13-11-8(10-12-13)7-4-3-5-9-6-7/h7,9H,2-6H2,1H3
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1.10E+3n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038238
PNG
(5-(2-Methyl-2H-tetrazol-5-yl)-1,2,3,6-tetrahydro-p...)
Show SMILES Cn1nnc(n1)C1=CCCNC1
Show InChI InChI=1S/C7H11N5/c1-12-10-7(9-11-12)6-3-2-4-8-5-6/h3,8H,2,4-5H2,1H3
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1.35E+3n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038231
PNG
(1-Butyl-5-(2-ethyl-2H-tetrazol-5-yl)-1,2,3,6-tetra...)
Show SMILES CCCCN1CCC=C(C1)c1nnn(CC)n1
Show InChI InChI=1S/C12H21N5/c1-3-5-8-16-9-6-7-11(10-16)12-13-15-17(4-2)14-12/h7H,3-6,8-10H2,1-2H3
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1.40E+3n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038233
PNG
(5-(3-Ethyl-3H-[1,2,3]triazol-4-yl)-1-methyl-1,2,3,...)
Show SMILES CCn1nncc1C1=CCCN(C)C1
Show InChI InChI=1S/C10H16N4/c1-3-14-10(7-11-12-14)9-5-4-6-13(2)8-9/h5,7H,3-4,6,8H2,1-2H3
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1.70E+3n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038222
PNG
(3-(2-Methyl-2H-tetrazol-5-yl)-piperidine | CHEMBL5...)
Show SMILES Cn1nnc(n1)C1CCCNC1
Show InChI InChI=1/C7H13N5/c1-12-10-7(9-11-12)6-3-2-4-8-5-6/h6,8H,2-5H2,1H3
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2.30E+3n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038229
PNG
(1-Methyl-3-(2-methyl-2H-tetrazol-5-yl)-piperidine ...)
Show SMILES CN1CCCC(C1)c1nnn(C)n1
Show InChI InChI=1/C8H15N5/c1-12-5-3-4-7(6-12)8-9-11-13(2)10-8/h7H,3-6H2,1-2H3
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4.80E+3n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50038240
PNG
(1-Methyl-5-(1-methyl-1H-tetrazol-5-yl)-1,2,3,6-tet...)
Show SMILES CN1CCC=C(C1)c1nnnn1C
Show InChI InChI=1S/C8H13N5/c1-12-5-3-4-7(6-12)8-9-10-11-13(8)2/h4H,3,5-6H2,1-2H3
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2.40E+4n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
In vitro binding affinity for muscarinic M1 receptor by displacing [3H]-Pirenzepine binding on rat brain homogenate.


J Med Chem 37: 4085-99 (1995)


Article DOI: 10.1021/jm00050a006
BindingDB Entry DOI: 10.7270/Q21N8066
More data for this
Ligand-Target Pair
Monoamine transporters; Norepinephrine & serotonin


(Rattus norvegicus (rat))
BDBM50021219
PNG
(CHEMBL553648 | [3-(2,4-Dichloro-phenyl)-indan-1-yl...)
Show SMILES CN(C)C1CC(c2ccccc12)c1ccc(Cl)cc1Cl
Show InChI InChI=1/C17H17Cl2N/c1-20(2)17-10-15(12-5-3-4-6-14(12)17)13-8-7-11(18)9-16(13)19/h3-9,15,17H,10H2,1-2H3
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n/an/a 0.0300n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of 5-HT uptake in rat synaptosomal fraction


J Med Chem 28: 1817-28 (1986)


Article DOI: 10.1021/jm00150a012
BindingDB Entry DOI: 10.7270/Q29W0G1M
More data for this
Ligand-Target Pair
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