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PubMed code 1433209

Compile data set for download or QSAR
Found 58 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


(Homo sapiens (Human))
BDBM50003355
PNG
(5-(4-Hexylsulfanyl-[1,2,5]thiadiazol-3-yl)-1-methy...)
Show SMILES CCCCCCSc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C14H23N3S2/c1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3
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n/an/a 0.00100n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Efficacy at muscarinic acetylcholine receptor M1 measured by the ability to inhibit the electrically stimulated twitch of the rabbit vas deferens


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50003363
PNG
(1-Methyl-5-(4-pentylsulfanyl-[1,2,5]thiadiazol-3-y...)
Show SMILES CCCCCSc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C13H21N3S2/c1-3-4-5-9-17-13-12(14-18-15-13)11-7-6-8-16(2)10-11/h7H,3-6,8-10H2,1-2H3
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n/an/a 0.00200n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Efficacy at muscarinic acetylcholine receptor M1 measured by the ability to inhibit the electrically stimulated twitch of the rabbit vas deferens


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50003366
PNG
(1-Methyl-5-(4-pentyloxy-[1,2,5]thiadiazol-3-yl)-1,...)
Show SMILES CCCCCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C13H21N3OS/c1-3-4-5-9-17-13-12(14-18-15-13)11-7-6-8-16(2)10-11/h7H,3-6,8-10H2,1-2H3
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n/an/a 0.00400n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Efficacy at muscarinic acetylcholine receptor M1 measured by the ability to inhibit the electrically stimulated twitch of the rabbit vas deferens


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50003359
PNG
(5-(4-Hexyloxy-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2...)
Show SMILES CCCCCCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C14H23N3OS/c1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3
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n/an/a 0.00800n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Efficacy at muscarinic acetylcholine receptor M1 measured by the ability to inhibit the electrically stimulated twitch of the rabbit vas deferens


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003351
PNG
(3-(4-butoxy-1,2,5-thiadiazol-3-yl)-1-methyl-1,2,5,...)
Show SMILES CCCCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C12H19N3OS/c1-3-4-8-16-12-11(13-17-14-12)10-6-5-7-15(2)9-10/h6H,3-5,7-9H2,1-2H3
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n/an/a 1.40n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-oxotremorine-M (Oxo-M) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003369
PNG
(1-Methyl-5-(4-propoxy-[1,2,5]thiadiazol-3-yl)-1,2,...)
Show SMILES CCCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C11H17N3OS/c1-3-7-15-11-10(12-16-13-11)9-5-4-6-14(2)8-9/h5H,3-4,6-8H2,1-2H3
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n/an/a 1.60n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus Muscarinic acetylcholine receptor M1 using [3H]-oxotremorine-M (Oxo-M) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003366
PNG
(1-Methyl-5-(4-pentyloxy-[1,2,5]thiadiazol-3-yl)-1,...)
Show SMILES CCCCCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C13H21N3OS/c1-3-4-5-9-17-13-12(14-18-15-13)11-7-6-8-16(2)10-11/h7H,3-6,8-10H2,1-2H3
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n/an/a 2n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-oxotremorine-M (Oxo-M) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003363
PNG
(1-Methyl-5-(4-pentylsulfanyl-[1,2,5]thiadiazol-3-y...)
Show SMILES CCCCCSc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C13H21N3S2/c1-3-4-5-9-17-13-12(14-18-15-13)11-7-6-8-16(2)10-11/h7H,3-6,8-10H2,1-2H3
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n/an/a 2.40n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-pirenzepine (Pz) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50003351
PNG
(3-(4-butoxy-1,2,5-thiadiazol-3-yl)-1-methyl-1,2,5,...)
Show SMILES CCCCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C12H19N3OS/c1-3-4-8-16-12-11(13-17-14-12)10-6-5-7-15(2)9-10/h6H,3-5,7-9H2,1-2H3
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n/an/a 3n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Efficacy at muscarinic acetylcholine receptor M1 measured by the ability to inhibit the electrically stimulated twitch of the rabbit vas deferens


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003366
PNG
(1-Methyl-5-(4-pentyloxy-[1,2,5]thiadiazol-3-yl)-1,...)
Show SMILES CCCCCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C13H21N3OS/c1-3-4-5-9-17-13-12(14-18-15-13)11-7-6-8-16(2)10-11/h7H,3-6,8-10H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-pirenzepine (Pz) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003363
PNG
(1-Methyl-5-(4-pentylsulfanyl-[1,2,5]thiadiazol-3-y...)
Show SMILES CCCCCSc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C13H21N3S2/c1-3-4-5-9-17-13-12(14-18-15-13)11-7-6-8-16(2)10-11/h7H,3-6,8-10H2,1-2H3
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n/an/a 4.80n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-oxotremorine-M (Oxo-M) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003355
PNG
(5-(4-Hexylsulfanyl-[1,2,5]thiadiazol-3-yl)-1-methy...)
Show SMILES CCCCCCSc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C14H23N3S2/c1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-pirenzepine (Pz) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003351
PNG
(3-(4-butoxy-1,2,5-thiadiazol-3-yl)-1-methyl-1,2,5,...)
Show SMILES CCCCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C12H19N3OS/c1-3-4-8-16-12-11(13-17-14-12)10-6-5-7-15(2)9-10/h6H,3-5,7-9H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-pirenzepine (Pz) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003365
PNG
(3-(3-(ethoxy)-1,2,5-thiadiazol-4-yl)-1,2,5,6-tetra...)
Show SMILES CCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C10H15N3OS/c1-3-14-10-9(11-15-12-10)8-5-4-6-13(2)7-8/h5H,3-4,6-7H2,1-2H3
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n/an/a 5.70n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-oxotremorine-M (Oxo-M) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003356
PNG
(5-(4-Heptyloxy-[1,2,5]thiadiazol-3-yl)-1-methyl-1,...)
Show SMILES CCCCCCCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C15H25N3OS/c1-3-4-5-6-7-11-19-15-14(16-20-17-15)13-9-8-10-18(2)12-13/h9H,3-8,10-12H2,1-2H3
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n/an/a 6.20n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-oxotremorine-M (Oxo-M) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003355
PNG
(5-(4-Hexylsulfanyl-[1,2,5]thiadiazol-3-yl)-1-methy...)
Show SMILES CCCCCCSc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C14H23N3S2/c1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3
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n/an/a 6.5n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-oxotremorine-M (Oxo-M) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003359
PNG
(5-(4-Hexyloxy-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2...)
Show SMILES CCCCCCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C14H23N3OS/c1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3
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n/an/a 7n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-pirenzepine (Pz) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50003356
PNG
(5-(4-Heptyloxy-[1,2,5]thiadiazol-3-yl)-1-methyl-1,...)
Show SMILES CCCCCCCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C15H25N3OS/c1-3-4-5-6-7-11-19-15-14(16-20-17-15)13-9-8-10-18(2)12-13/h9H,3-8,10-12H2,1-2H3
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n/an/a 9n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Efficacy at muscarinic acetylcholine receptor M1 measured by the ability to inhibit the electrically stimulated twitch of the rabbit vas deferens


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003359
PNG
(5-(4-Hexyloxy-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2...)
Show SMILES CCCCCCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C14H23N3OS/c1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3
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n/an/a 9.70n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-oxotremorine-M (Oxo-M) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003362
PNG
(2-(1-Methyl-1,2,5,6-tetrahydro-pyridin-3-yl)-3-pen...)
Show SMILES CCCCCSc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C15H23N3S/c1-3-4-5-11-19-15-14(16-8-9-17-15)13-7-6-10-18(2)12-13/h7-9H,3-6,10-12H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-pirenzepine (Pz) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003358
PNG
(5-(4-Chloro-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2,3...)
Show SMILES CN1CCC=C(C1)c1nsnc1Cl
Show InChI InChI=1S/C8H10ClN3S/c1-12-4-2-3-6(5-12)7-8(9)11-13-10-7/h3H,2,4-5H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-oxotremorine-M (Oxo-M) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003356
PNG
(5-(4-Heptyloxy-[1,2,5]thiadiazol-3-yl)-1-methyl-1,...)
Show SMILES CCCCCCCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C15H25N3OS/c1-3-4-5-6-7-11-19-15-14(16-20-17-15)13-9-8-10-18(2)12-13/h9H,3-8,10-12H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-pirenzepine (Pz) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003362
PNG
(2-(1-Methyl-1,2,5,6-tetrahydro-pyridin-3-yl)-3-pen...)
Show SMILES CCCCCSc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C15H23N3S/c1-3-4-5-11-19-15-14(16-8-9-17-15)13-7-6-10-18(2)12-13/h7-9H,3-6,10-12H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-oxotremorine-M (Oxo-M) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003354
PNG
(2-(1-Methyl-1,2,5,6-tetrahydro-pyridin-3-yl)-3-pen...)
Show SMILES CCCCCOc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C15H23N3O/c1-3-4-5-11-19-15-14(16-8-9-17-15)13-7-6-10-18(2)12-13/h7-9H,3-6,10-12H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-pirenzepine (Pz) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003357
PNG
(2-Butoxy-3-(1-methyl-1,2,5,6-tetrahydro-pyridin-3-...)
Show SMILES CCCCOc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C14H21N3O/c1-3-4-10-18-14-13(15-7-8-16-14)12-6-5-9-17(2)11-12/h6-8H,3-5,9-11H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-oxotremorine-M (Oxo-M) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003364
PNG
(2-Hexyloxy-3-(1-methyl-1,2,5,6-tetrahydro-pyridin-...)
Show SMILES CCCCCCOc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C16H25N3O/c1-3-4-5-6-12-20-16-15(17-9-10-18-16)14-8-7-11-19(2)13-14/h8-10H,3-7,11-13H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-pirenzepine (Pz) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003357
PNG
(2-Butoxy-3-(1-methyl-1,2,5,6-tetrahydro-pyridin-3-...)
Show SMILES CCCCOc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C14H21N3O/c1-3-4-10-18-14-13(15-7-8-16-14)12-6-5-9-17(2)11-12/h6-8H,3-5,9-11H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-pirenzepine (Pz) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003349
PNG
(2-Heptyloxy-3-(1-methyl-1,2,5,6-tetrahydro-pyridin...)
Show SMILES CCCCCCCOc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C17H27N3O/c1-3-4-5-6-7-13-21-17-16(18-10-11-19-17)15-9-8-12-20(2)14-15/h9-11H,3-8,12-14H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-oxotremorine-M (Oxo-M) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003369
PNG
(1-Methyl-5-(4-propoxy-[1,2,5]thiadiazol-3-yl)-1,2,...)
Show SMILES CCCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C11H17N3OS/c1-3-7-15-11-10(12-16-13-11)9-5-4-6-14(2)8-9/h5H,3-4,6-8H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus Muscarinic acetylcholine receptor M1 using [3H]-pirenzepine (Pz) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003354
PNG
(2-(1-Methyl-1,2,5,6-tetrahydro-pyridin-3-yl)-3-pen...)
Show SMILES CCCCCOc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C15H23N3O/c1-3-4-5-11-19-15-14(16-8-9-17-15)13-7-6-10-18(2)12-13/h7-9H,3-6,10-12H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-oxotremorine-M (Oxo-M) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003364
PNG
(2-Hexyloxy-3-(1-methyl-1,2,5,6-tetrahydro-pyridin-...)
Show SMILES CCCCCCOc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C16H25N3O/c1-3-4-5-6-12-20-16-15(17-9-10-18-16)14-8-7-11-19(2)13-14/h8-10H,3-7,11-13H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-oxotremorine-M (Oxo-M) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003361
PNG
(5-(4-Methoxy-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2,...)
Show SMILES COc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C9H13N3OS/c1-12-5-3-4-7(6-12)8-9(13-2)11-14-10-8/h4H,3,5-6H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-oxotremorine-M (Oxo-M) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003349
PNG
(2-Heptyloxy-3-(1-methyl-1,2,5,6-tetrahydro-pyridin...)
Show SMILES CCCCCCCOc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C17H27N3O/c1-3-4-5-6-7-13-21-17-16(18-10-11-19-17)15-9-8-12-20(2)14-15/h9-11H,3-8,12-14H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-pirenzepine (Pz) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003352
PNG
(2-Hexylsulfanyl-3-(1-methyl-1,2,5,6-tetrahydro-pyr...)
Show SMILES CCCCCCSc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C16H25N3S/c1-3-4-5-6-12-20-16-15(17-9-10-18-16)14-8-7-11-19(2)13-14/h8-10H,3-7,11-13H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-pirenzepine (Pz) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003352
PNG
(2-Hexylsulfanyl-3-(1-methyl-1,2,5,6-tetrahydro-pyr...)
Show SMILES CCCCCCSc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C16H25N3S/c1-3-4-5-6-12-20-16-15(17-9-10-18-16)14-8-7-11-19(2)13-14/h8-10H,3-7,11-13H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-oxotremorine-M (Oxo-M) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003365
PNG
(3-(3-(ethoxy)-1,2,5-thiadiazol-4-yl)-1,2,5,6-tetra...)
Show SMILES CCOc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C10H15N3OS/c1-3-14-10-9(11-15-12-10)8-5-4-6-13(2)7-8/h5H,3-4,6-7H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-pirenzepine (Pz) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003360
PNG
(2-(1-Methyl-1,2,5,6-tetrahydro-pyridin-3-yl)-3-pro...)
Show SMILES CCCOc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C13H19N3O/c1-3-9-17-13-12(14-6-7-15-13)11-5-4-8-16(2)10-11/h5-7H,3-4,8-10H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-oxotremorine-M (Oxo-M) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003372
PNG
(CHEMBL308168 | Hexyl-[4-(1-methyl-1,2,5,6-tetrahyd...)
Show SMILES CCCCCCNc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C14H24N4S/c1-3-4-5-6-9-15-14-13(16-19-17-14)12-8-7-10-18(2)11-12/h8H,3-7,9-11H2,1-2H3,(H,15,17)
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-oxotremorine-M (Oxo-M) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003360
PNG
(2-(1-Methyl-1,2,5,6-tetrahydro-pyridin-3-yl)-3-pro...)
Show SMILES CCCOc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C13H19N3O/c1-3-9-17-13-12(14-6-7-15-13)11-5-4-8-16(2)10-11/h5-7H,3-4,8-10H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-pirenzepine (Pz) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003350
PNG
(5-(4-Heptyl-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2,3...)
Show SMILES CCCCCCCc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C15H25N3S/c1-3-4-5-6-7-10-14-15(17-19-16-14)13-9-8-11-18(2)12-13/h9H,3-8,10-12H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-pirenzepine (Pz) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM46858
PNG
(1-methyl-3,6-dihydro-2H-pyridine-5-carboxylic acid...)
Show SMILES COC(=O)C1=CCCN(C)C1
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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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-oxotremorine-M (Oxo-M) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003371
PNG
(5-(4-Hexyloxy-furazan-3-yl)-1-methyl-1,2,3,6-tetra...)
Show SMILES CCCCCCOc1nonc1C1=CCCN(C)C1
Show InChI InChI=1S/C14H23N3O2/c1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-oxotremorine-M (Oxo-M) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003372
PNG
(CHEMBL308168 | Hexyl-[4-(1-methyl-1,2,5,6-tetrahyd...)
Show SMILES CCCCCCNc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C14H24N4S/c1-3-4-5-6-9-15-14-13(16-19-17-14)12-8-7-10-18(2)11-12/h8H,3-7,9-11H2,1-2H3,(H,15,17)
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-pirenzepine (Pz) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003361
PNG
(5-(4-Methoxy-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2,...)
Show SMILES COc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C9H13N3OS/c1-12-5-3-4-7(6-12)8-9(13-2)11-14-10-8/h4H,3,5-6H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-pirenzepine (Pz) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003367
PNG
(2-Ethoxy-3-(1-methyl-1,2,5,6-tetrahydro-pyridin-3-...)
Show SMILES CCOc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C12H17N3O/c1-3-16-12-11(13-6-7-14-12)10-5-4-8-15(2)9-10/h5-7H,3-4,8-9H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-pirenzepine (Pz) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003350
PNG
(5-(4-Heptyl-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2,3...)
Show SMILES CCCCCCCc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C15H25N3S/c1-3-4-5-6-7-10-14-15(17-19-16-14)13-9-8-11-18(2)12-13/h9H,3-8,10-12H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-oxotremorine-M (Oxo-M) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003367
PNG
(2-Ethoxy-3-(1-methyl-1,2,5,6-tetrahydro-pyridin-3-...)
Show SMILES CCOc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C12H17N3O/c1-3-16-12-11(13-6-7-14-12)10-5-4-8-15(2)9-10/h5-7H,3-4,8-9H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-oxotremorine-M (Oxo-M) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50003350
PNG
(5-(4-Heptyl-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2,3...)
Show SMILES CCCCCCCc1nsnc1C1=CCCN(C)C1
Show InChI InChI=1S/C15H25N3S/c1-3-4-5-6-7-10-14-15(17-19-16-14)13-9-8-11-18(2)12-13/h9H,3-8,10-12H2,1-2H3
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n/an/a 224n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Efficacy at muscarinic acetylcholine receptor M1 measured by the ability to inhibit the electrically stimulated twitch of the rabbit vas deferens


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003353
PNG
(2-Chloro-3-(1-methyl-1,2,5,6-tetrahydro-pyridin-3-...)
Show SMILES CN1CCC=C(C1)c1nccnc1Cl
Show InChI InChI=1S/C10H12ClN3/c1-14-6-2-3-8(7-14)9-10(11)13-5-4-12-9/h3-5H,2,6-7H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-oxotremorine-M (Oxo-M) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003371
PNG
(5-(4-Hexyloxy-furazan-3-yl)-1-methyl-1,2,3,6-tetra...)
Show SMILES CCCCCCOc1nonc1C1=CCCN(C)C1
Show InChI InChI=1S/C14H23N3O2/c1-3-4-5-6-10-18-14-13(15-19-16-14)12-8-7-9-17(2)11-12/h8H,3-7,9-11H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-pirenzepine (Pz) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003358
PNG
(5-(4-Chloro-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2,3...)
Show SMILES CN1CCC=C(C1)c1nsnc1Cl
Show InChI InChI=1S/C8H10ClN3S/c1-12-4-2-3-6(5-12)7-8(9)11-13-10-7/h3H,2,4-5H2,1H3
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n/an/a 375n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-pirenzepine (Pz) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50003358
PNG
(5-(4-Chloro-[1,2,5]thiadiazol-3-yl)-1-methyl-1,2,3...)
Show SMILES CN1CCC=C(C1)c1nsnc1Cl
Show InChI InChI=1S/C8H10ClN3S/c1-12-4-2-3-6(5-12)7-8(9)11-13-10-7/h3H,2,4-5H2,1H3
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PubMed
n/an/a 537n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Efficacy at muscarinic acetylcholine receptor M1 measured by the ability to inhibit the electrically stimulated twitch of the rabbit vas deferens


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM46858
PNG
(1-methyl-3,6-dihydro-2H-pyridine-5-carboxylic acid...)
Show SMILES COC(=O)C1=CCCN(C)C1
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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PubMed
n/an/a 545n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Efficacy at muscarinic acetylcholine receptor M1 measured by the ability to inhibit the electrically stimulated twitch of the rabbit vas deferens


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003370
PNG
(2-Methoxy-3-(1-methyl-1,2,5,6-tetrahydro-pyridin-3...)
Show SMILES COc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C11H15N3O/c1-14-7-3-4-9(8-14)10-11(15-2)13-6-5-12-10/h4-6H,3,7-8H2,1-2H3
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n/an/a 840n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-pirenzepine (Pz) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003370
PNG
(2-Methoxy-3-(1-methyl-1,2,5,6-tetrahydro-pyridin-3...)
Show SMILES COc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C11H15N3O/c1-14-7-3-4-9(8-14)10-11(15-2)13-6-5-12-10/h4-6H,3,7-8H2,1-2H3
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n/an/a 850n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
In vitro binding affinity against rat hippocampus M1 receptor using [3H]-oxotremorine-M (Oxo-M) as radioligand


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50003353
PNG
(2-Chloro-3-(1-methyl-1,2,5,6-tetrahydro-pyridin-3-...)
Show SMILES CN1CCC=C(C1)c1nccnc1Cl
Show InChI InChI=1S/C10H12ClN3/c1-14-6-2-3-8(7-14)9-10(11)13-5-4-12-9/h3-5H,2,6-7H2,1H3
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n/an/a>1.00E+3n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-pirenzepine (Pz) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM46858
PNG
(1-methyl-3,6-dihydro-2H-pyridine-5-carboxylic acid...)
Show SMILES COC(=O)C1=CCCN(C)C1
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 1.30E+3n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Displacement of [3H]-pirenzepine (Pz) from rat hippocampus muscarinic acetylcholine receptor M1


Citation and Details
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50003349
PNG
(2-Heptyloxy-3-(1-methyl-1,2,5,6-tetrahydro-pyridin...)
Show SMILES CCCCCCCOc1nccnc1C1=CCCN(C)C1
Show InChI InChI=1S/C17H27N3O/c1-3-4-5-6-7-13-21-17-16(18-10-11-19-17)15-9-8-12-20(2)14-15/h9-11H,3-8,12-14H2,1-2H3
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n/an/a 5.10E+3n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Efficacy at muscarinic acetylcholine receptor M1 measured by the ability to inhibit the electrically stimulated twitch of the rabbit vas deferens


Citation and Details
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%