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Compile Data Set for Download or QSAR

Found 59 hits with Last Name = 'deeter' and Initial = 'jb'   
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


(RAT)
BDBM50033155
PNG
(3-(3-Butylsulfanyl-pyrazin-2-yl)-1-aza-bicyclo[2.2...)
Show SMILES CCCCSc1nccnc1C1CN2CCC1CC2 |(4.41,-8.01,;5.75,-8.78,;5.74,-10.32,;7.07,-11.09,;7.07,-12.63,;8.4,-13.4,;9.74,-12.65,;11.07,-13.42,;11.07,-14.96,;9.73,-15.71,;8.41,-14.94,;7.07,-15.71,;7.07,-17.25,;5.74,-18.01,;6.28,-16.47,;5,-16.36,;5.74,-14.93,;4.42,-15.71,;4.42,-17.25,)|
Show InChI InChI=1S/C15H23N3S/c1-2-3-10-19-15-14(16-6-7-17-15)13-11-18-8-4-12(13)5-9-18/h6-7,12-13H,2-5,8-11H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033155
PNG
(3-(3-Butylsulfanyl-pyrazin-2-yl)-1-aza-bicyclo[2.2...)
Show SMILES CCCCSc1nccnc1C1CN2CCC1CC2 |(4.41,-8.01,;5.75,-8.78,;5.74,-10.32,;7.07,-11.09,;7.07,-12.63,;8.4,-13.4,;9.74,-12.65,;11.07,-13.42,;11.07,-14.96,;9.73,-15.71,;8.41,-14.94,;7.07,-15.71,;7.07,-17.25,;5.74,-18.01,;6.28,-16.47,;5,-16.36,;5.74,-14.93,;4.42,-15.71,;4.42,-17.25,)|
Show InChI InChI=1S/C15H23N3S/c1-2-3-10-19-15-14(16-6-7-17-15)13-11-18-8-4-12(13)5-9-18/h6-7,12-13H,2-5,8-11H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033162
PNG
(3-(3-Pentylsulfanyl-pyrazin-2-yl)-1-aza-bicyclo[2....)
Show SMILES CCCCCSc1nccnc1C1CN2CCC1CC2 |(5.44,2.49,;5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C16H25N3S/c1-2-3-4-11-20-16-15(17-7-8-18-16)14-12-19-9-5-13(14)6-10-19/h7-8,13-14H,2-6,9-12H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033162
PNG
(3-(3-Pentylsulfanyl-pyrazin-2-yl)-1-aza-bicyclo[2....)
Show SMILES CCCCCSc1nccnc1C1CN2CCC1CC2 |(5.44,2.49,;5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C16H25N3S/c1-2-3-4-11-20-16-15(17-7-8-18-16)14-12-19-9-5-13(14)6-10-19/h7-8,13-14H,2-6,9-12H2,1H3
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n/an/a 1.10n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033151
PNG
(3-(3-Hexylsulfanyl-pyrazin-2-yl)-1-aza-bicyclo[2.2...)
Show SMILES CCCCCCSc1nccnc1C1CN2CCC1CC2 |(4.09,3.27,;5.44,2.49,;5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C17H27N3S/c1-2-3-4-5-12-21-17-16(18-8-9-19-17)15-13-20-10-6-14(15)7-11-20/h8-9,14-15H,2-7,10-13H2,1H3
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n/an/a 2n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
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 |t:13|
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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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033151
PNG
(3-(3-Hexylsulfanyl-pyrazin-2-yl)-1-aza-bicyclo[2.2...)
Show SMILES CCCCCCSc1nccnc1C1CN2CCC1CC2 |(4.09,3.27,;5.44,2.49,;5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C17H27N3S/c1-2-3-4-5-12-21-17-16(18-8-9-19-17)15-13-20-10-6-14(15)7-11-20/h8-9,14-15H,2-7,10-13H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033152
PNG
((R)-6-(3-Hexyloxy-pyrazin-2-yl)-1-aza-bicyclo[3.2....)
Show SMILES CCCCCCOc1nccnc1[C@H]1CN2CC1CCC2 |TLB:12:13:16:20.18.19|
Show InChI InChI=1S/C17H27N3O/c1-2-3-4-5-11-21-17-16(18-8-9-19-17)15-13-20-10-6-7-14(15)12-20/h8-9,14-15H,2-7,10-13H2,1H3/t14?,15-/m0/s1
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50453786
PNG
(CHEMBL2092949)
Show SMILES CCCCCCOc1nccnc1[C@@H]1CN2CCC1CC2 |r,wD:13.13,(4.09,3.27,;5.44,2.49,;5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C17H27N3O/c1-2-3-4-5-12-21-17-16(18-8-9-19-17)15-13-20-10-6-14(15)7-11-20/h8-9,14-15H,2-7,10-13H2,1H3/t15-/m1/s1
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50453786
PNG
(CHEMBL2092949)
Show SMILES CCCCCCOc1nccnc1[C@@H]1CN2CCC1CC2 |r,wD:13.13,(4.09,3.27,;5.44,2.49,;5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C17H27N3O/c1-2-3-4-5-12-21-17-16(18-8-9-19-17)15-13-20-10-6-14(15)7-11-20/h8-9,14-15H,2-7,10-13H2,1H3/t15-/m1/s1
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n/an/a 3.70n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033152
PNG
((R)-6-(3-Hexyloxy-pyrazin-2-yl)-1-aza-bicyclo[3.2....)
Show SMILES CCCCCCOc1nccnc1[C@H]1CN2CC1CCC2 |TLB:12:13:16:20.18.19|
Show InChI InChI=1S/C17H27N3O/c1-2-3-4-5-11-21-17-16(18-8-9-19-17)15-13-20-10-6-7-14(15)12-20/h8-9,14-15H,2-7,10-13H2,1H3/t14?,15-/m0/s1
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033149
PNG
(3-Pyrazin-2-yl-1-aza-bicyclo[2.2.2]octane | 3-Pyra...)
Show SMILES C1CN2CCC1C(C2)c1cnccn1 |(3.06,-3.22,;4.53,-3.62,;3.83,-4.97,;2.5,-4.21,;2.5,-2.67,;3.83,-1.89,;5.16,-2.67,;5.16,-4.21,;6.49,-1.9,;6.49,-.36,;7.82,.41,;9.17,-.37,;9.15,-1.91,;7.82,-2.67,)|
Show InChI InChI=1S/C11H15N3/c1-5-14-6-2-9(1)10(8-14)11-7-12-3-4-13-11/h3-4,7,9-10H,1-2,5-6,8H2
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033148
PNG
(3-(3-Hexyloxy-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]oc...)
Show SMILES CCCCCCOc1nccnc1C1CN2CCC1CC2 |(4.09,3.27,;5.44,2.49,;5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C17H27N3O/c1-2-3-4-5-12-21-17-16(18-8-9-19-17)15-13-20-10-6-14(15)7-11-20/h8-9,14-15H,2-7,10-13H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033163
PNG
(3-(6-Chloro-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]octa...)
Show SMILES Clc1cncc(n1)C1CN2CCC1CC2 |(10.48,-2.69,;9.15,-1.91,;9.17,-.37,;7.82,.41,;6.49,-.36,;6.49,-1.9,;7.82,-2.67,;5.16,-2.67,;5.16,-4.21,;3.83,-4.97,;2.5,-4.21,;2.5,-2.67,;3.83,-1.89,;3.06,-3.22,;4.53,-3.62,)|
Show InChI InChI=1S/C11H14ClN3/c12-11-6-13-5-10(14-11)9-7-15-3-1-8(9)2-4-15/h5-6,8-9H,1-4,7H2
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n/an/a 4.70n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033163
PNG
(3-(6-Chloro-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]octa...)
Show SMILES Clc1cncc(n1)C1CN2CCC1CC2 |(10.48,-2.69,;9.15,-1.91,;9.17,-.37,;7.82,.41,;6.49,-.36,;6.49,-1.9,;7.82,-2.67,;5.16,-2.67,;5.16,-4.21,;3.83,-4.97,;2.5,-4.21,;2.5,-2.67,;3.83,-1.89,;3.06,-3.22,;4.53,-3.62,)|
Show InChI InChI=1S/C11H14ClN3/c12-11-6-13-5-10(14-11)9-7-15-3-1-8(9)2-4-15/h5-6,8-9H,1-4,7H2
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033147
PNG
(3-(3-Butoxy-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]octa...)
Show SMILES CCCCOc1nccnc1C1CN2CCC1CC2 |(5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C15H23N3O/c1-2-3-10-19-15-14(16-6-7-17-15)13-11-18-8-4-12(13)5-9-18/h6-7,12-13H,2-5,8-11H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
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 |t:13|
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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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033153
PNG
((R)-3-(3-Hexyloxy-pyrazin-2-yl)-1-aza-bicyclo[2.2....)
Show SMILES CCCCCCOc1nccnc1[C@H]1CN2CCC1C2 |THB:12:13:19:17.16|
Show InChI InChI=1S/C16H25N3O/c1-2-3-4-5-10-20-16-15(17-7-8-18-16)14-12-19-9-6-13(14)11-19/h7-8,13-14H,2-6,9-12H2,1H3/t13?,14-/m0/s1
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033158
PNG
(3-(3-Pentyloxy-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]o...)
Show SMILES CCCCCOc1nccnc1C1CN2CCC1CC2 |(5.44,2.49,;5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C16H25N3O/c1-2-3-4-11-20-16-15(17-7-8-18-16)14-12-19-9-5-13(14)6-10-19/h7-8,13-14H,2-6,9-12H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033148
PNG
(3-(3-Hexyloxy-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]oc...)
Show SMILES CCCCCCOc1nccnc1C1CN2CCC1CC2 |(4.09,3.27,;5.44,2.49,;5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C17H27N3O/c1-2-3-4-5-12-21-17-16(18-8-9-19-17)15-13-20-10-6-14(15)7-11-20/h8-9,14-15H,2-7,10-13H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033158
PNG
(3-(3-Pentyloxy-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]o...)
Show SMILES CCCCCOc1nccnc1C1CN2CCC1CC2 |(5.44,2.49,;5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C16H25N3O/c1-2-3-4-11-20-16-15(17-7-8-18-16)14-12-19-9-5-13(14)6-10-19/h7-8,13-14H,2-6,9-12H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033153
PNG
((R)-3-(3-Hexyloxy-pyrazin-2-yl)-1-aza-bicyclo[2.2....)
Show SMILES CCCCCCOc1nccnc1[C@H]1CN2CCC1C2 |THB:12:13:19:17.16|
Show InChI InChI=1S/C16H25N3O/c1-2-3-4-5-10-20-16-15(17-7-8-18-16)14-12-19-9-6-13(14)11-19/h7-8,13-14H,2-6,9-12H2,1H3/t13?,14-/m0/s1
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033154
PNG
(3-(3-Propoxy-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]oct...)
Show SMILES CCCOc1nccnc1C1CN2CCC1CC2 |(6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C14H21N3O/c1-2-9-18-14-13(15-5-6-16-14)12-10-17-7-3-11(12)4-8-17/h5-6,11-12H,2-4,7-10H2,1H3
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n/an/a 9n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(MOUSE)
BDBM50006842
PNG
(2-[2-(5-Bromo-1H-indol-3-yl)-ethyl]-3-(3-isopropox...)
Show SMILES CC(C)Oc1cccc(c1)-n1c(CCc2c[nH]c3ccc(Br)cc23)nc2ccccc2c1=O
Show InChI InChI=1S/C27H24BrN3O2/c1-17(2)33-21-7-5-6-20(15-21)31-26(30-25-9-4-3-8-22(25)27(31)32)13-10-18-16-29-24-12-11-19(28)14-23(18)24/h3-9,11-12,14-17,29H,10,13H2,1-2H3
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n/an/a 9.30n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for inhibition of [125I]-CCK-8S binding to cholecystokinin CCK-B receptor from mouse brain membranes at a concentration of 10 microM (in vi...


J Med Chem 35: 2534-42 (1992)


BindingDB Entry DOI: 10.7270/Q2JM28MX
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033147
PNG
(3-(3-Butoxy-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]octa...)
Show SMILES CCCCOc1nccnc1C1CN2CCC1CC2 |(5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C15H23N3O/c1-2-3-10-19-15-14(16-6-7-17-15)13-11-18-8-4-12(13)5-9-18/h6-7,12-13H,2-5,8-11H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033150
PNG
(3-(3-Heptyloxy-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]o...)
Show SMILES CCCCCCCOc1nccnc1C1CN2CCC1CC2 |(4.11,4.82,;4.09,3.27,;5.44,2.49,;5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C18H29N3O/c1-2-3-4-5-6-13-22-18-17(19-9-10-20-18)16-14-21-11-7-15(16)8-12-21/h9-10,15-16H,2-8,11-14H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50369037
PNG
(CHEMBL1788236)
Show SMILES CCCCCCOc1nccnc1[C@H]1CN2CCC1CC2 |r,wU:13.13,(4.09,3.27,;5.44,2.49,;5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C17H27N3O/c1-2-3-4-5-12-21-17-16(18-8-9-19-17)15-13-20-10-6-14(15)7-11-20/h8-9,14-15H,2-7,10-13H2,1H3/t15-/m0/s1
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50369037
PNG
(CHEMBL1788236)
Show SMILES CCCCCCOc1nccnc1[C@H]1CN2CCC1CC2 |r,wU:13.13,(4.09,3.27,;5.44,2.49,;5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C17H27N3O/c1-2-3-4-5-12-21-17-16(18-8-9-19-17)15-13-20-10-6-14(15)7-11-20/h8-9,14-15H,2-7,10-13H2,1H3/t15-/m0/s1
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033150
PNG
(3-(3-Heptyloxy-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]o...)
Show SMILES CCCCCCCOc1nccnc1C1CN2CCC1CC2 |(4.11,4.82,;4.09,3.27,;5.44,2.49,;5.44,.95,;6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C18H29N3O/c1-2-3-4-5-6-13-22-18-17(19-9-10-20-18)16-14-21-11-7-15(16)8-12-21/h9-10,15-16H,2-8,11-14H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
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 |t:14|
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
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033154
PNG
(3-(3-Propoxy-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]oct...)
Show SMILES CCCOc1nccnc1C1CN2CCC1CC2 |(6.77,.18,;6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C14H21N3O/c1-2-9-18-14-13(15-5-6-16-14)12-10-17-7-3-11(12)4-8-17/h5-6,11-12H,2-4,7-10H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
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 |t:14|
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
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033161
PNG
(3-(3-Ethoxy-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]octa...)
Show SMILES CCOc1nccnc1C1CN2CCC1CC2 |(6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C13H19N3O/c1-2-17-13-12(14-5-6-15-13)11-9-16-7-3-10(11)4-8-16/h5-6,10-11H,2-4,7-9H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033157
PNG
(3-(3-Methyl-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]octa...)
Show SMILES Cc1nccnc1C1CN2CCC1CC2 |(5.16,.4,;6.49,-.36,;7.82,.41,;9.17,-.37,;9.15,-1.91,;7.82,-2.67,;6.49,-1.9,;5.16,-2.67,;5.16,-4.21,;3.83,-4.97,;2.5,-4.21,;2.5,-2.67,;3.83,-1.89,;3.06,-3.22,;4.53,-3.62,)|
Show InChI InChI=1S/C12H17N3/c1-9-12(14-5-4-13-9)11-8-15-6-2-10(11)3-7-15/h4-5,10-11H,2-3,6-8H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033159
PNG
(6-(3-Hexyloxy-pyrazin-2-yl)-1-methyl-2,3,4,7-tetra...)
Show SMILES CCCCCCOc1nccnc1C1=CCCCN(C)C1 |t:14|
Show InChI InChI=1S/C17H27N3O/c1-3-4-5-8-13-21-17-16(18-10-11-19-17)15-9-6-7-12-20(2)14-15/h9-11H,3-8,12-14H2,1-2H3
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n/an/a 26n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(MOUSE)
BDBM50006838
PNG
(2-[2-(1H-Indol-3-yl)-ethyl]-3-(3-isopropoxy-phenyl...)
Show SMILES CC(C)Oc1cccc(c1)-n1c(CCc2c[nH]c3ccccc23)nc2ccccc2c1=O
Show InChI InChI=1S/C27H25N3O2/c1-18(2)32-21-9-7-8-20(16-21)30-26(29-25-13-6-4-11-23(25)27(30)31)15-14-19-17-28-24-12-5-3-10-22(19)24/h3-13,16-18,28H,14-15H2,1-2H3
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n/an/a 26n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for inhibition of [125I]-CCK-8S binding to cholecystokinin CCK-B receptor from mouse brain membranes at a concentration of 10 microM (in vi...


J Med Chem 35: 2534-42 (1992)


BindingDB Entry DOI: 10.7270/Q2JM28MX
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033161
PNG
(3-(3-Ethoxy-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]octa...)
Show SMILES CCOc1nccnc1C1CN2CCC1CC2 |(6.77,-1.36,;8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C13H19N3O/c1-2-17-13-12(14-5-6-15-13)11-9-16-7-3-10(11)4-8-16/h5-6,10-11H,2-4,7-9H2,1H3
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n/an/a 38n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033145
PNG
(6-(3-Hexyloxy-pyrazin-2-yl)-2,3,4,7-tetrahydro-1H-...)
Show SMILES CCCCCCOc1nccnc1C1=CCCCNC1 |t:14|
Show InChI InChI=1S/C16H25N3O/c1-2-3-4-7-12-20-16-15(18-10-11-19-16)14-8-5-6-9-17-13-14/h8,10-11,17H,2-7,9,12-13H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033146
PNG
((S)-3-(3-Hexyloxy-pyrazin-2-yl)-1-aza-bicyclo[2.2....)
Show SMILES CCCCCCOc1nccnc1[C@@H]1CN2CCC1C2
Show InChI InChI=1S/C16H25N3O/c1-2-3-4-5-10-20-16-15(17-7-8-18-16)14-12-19-9-6-13(14)11-19/h7-8,13-14H,2-6,9-12H2,1H3/t13?,14-/m1/s1
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n/an/a 46n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033160
PNG
(3-(3-Chloro-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]octa...)
Show SMILES Clc1nccnc1C1CN2CCC1CC2 |(8.76,-3.74,;10.09,-4.51,;11.44,-3.76,;12.77,-4.53,;12.76,-6.07,;11.42,-6.82,;10.1,-6.05,;8.76,-6.82,;8.76,-8.36,;7.43,-9.12,;7.98,-7.58,;6.7,-7.47,;7.43,-6.04,;6.11,-6.82,;6.11,-8.36,)|
Show InChI InChI=1S/C11H14ClN3/c12-11-10(13-3-4-14-11)9-7-15-5-1-8(9)2-6-15/h3-4,8-9H,1-2,5-7H2
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033146
PNG
((S)-3-(3-Hexyloxy-pyrazin-2-yl)-1-aza-bicyclo[2.2....)
Show SMILES CCCCCCOc1nccnc1[C@@H]1CN2CCC1C2
Show InChI InChI=1S/C16H25N3O/c1-2-3-4-5-10-20-16-15(17-7-8-18-16)14-12-19-9-6-13(14)11-19/h7-8,13-14H,2-6,9-12H2,1H3/t13?,14-/m1/s1
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n/an/a 58n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Cholecystokinin receptor


(MOUSE)
BDBM50006839
PNG
(2-[2-(1H-Indol-3-yl)-propyl]-3-(3-isopropoxy-pheny...)
Show SMILES CC(C)Oc1cccc(c1)-n1c(CC(C)c2c[nH]c3ccccc23)nc2ccccc2c1=O
Show InChI InChI=1S/C28H27N3O2/c1-18(2)33-21-10-8-9-20(16-21)31-27(30-26-14-7-5-12-23(26)28(31)32)15-19(3)24-17-29-25-13-6-4-11-22(24)25/h4-14,16-19,29H,15H2,1-3H3
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n/an/a 70n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Evaluated for inhibition of [125I]-CCK-8S binding to cholecystokinin CCK-B receptor from mouse brain membranes at a concentration of 10 microM (in vi...


J Med Chem 35: 2534-42 (1992)


BindingDB Entry DOI: 10.7270/Q2JM28MX
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033144
PNG
(3-(3-Methoxy-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]oct...)
Show SMILES COc1nccnc1C1CN2CCC1CC2 |(8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C12H17N3O/c1-16-12-11(13-4-5-14-12)10-8-15-6-2-9(10)3-7-15/h4-5,9-10H,2-3,6-8H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033149
PNG
(3-Pyrazin-2-yl-1-aza-bicyclo[2.2.2]octane | 3-Pyra...)
Show SMILES C1CN2CCC1C(C2)c1cnccn1 |(3.06,-3.22,;4.53,-3.62,;3.83,-4.97,;2.5,-4.21,;2.5,-2.67,;3.83,-1.89,;5.16,-2.67,;5.16,-4.21,;6.49,-1.9,;6.49,-.36,;7.82,.41,;9.17,-.37,;9.15,-1.91,;7.82,-2.67,)|
Show InChI InChI=1S/C11H15N3/c1-5-14-6-2-9(1)10(8-14)11-7-12-3-4-13-11/h3-4,7,9-10H,1-2,5-6,8H2
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n/an/a 74n/an/an/an/an/an/a



Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
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 |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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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033157
PNG
(3-(3-Methyl-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]octa...)
Show SMILES Cc1nccnc1C1CN2CCC1CC2 |(5.16,.4,;6.49,-.36,;7.82,.41,;9.17,-.37,;9.15,-1.91,;7.82,-2.67,;6.49,-1.9,;5.16,-2.67,;5.16,-4.21,;3.83,-4.97,;2.5,-4.21,;2.5,-2.67,;3.83,-1.89,;3.06,-3.22,;4.53,-3.62,)|
Show InChI InChI=1S/C12H17N3/c1-9-12(14-5-4-13-9)11-8-15-6-2-10(11)3-7-15/h4-5,10-11H,2-3,6-8H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033144
PNG
(3-(3-Methoxy-pyrazin-2-yl)-1-aza-bicyclo[2.2.2]oct...)
Show SMILES COc1nccnc1C1CN2CCC1CC2 |(8.1,-2.13,;8.1,-3.67,;9.43,-4.44,;10.76,-3.69,;12.09,-4.46,;12.09,-6,;10.76,-6.75,;9.43,-5.98,;8.1,-6.75,;8.1,-8.29,;6.77,-9.05,;7.31,-7.51,;6.03,-7.4,;6.77,-5.97,;5.44,-6.75,;5.44,-8.29,)|
Show InChI InChI=1S/C12H17N3O/c1-16-12-11(13-4-5-14-12)10-8-15-6-2-9(10)3-7-15/h4-5,9-10H,2-3,6-8H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033159
PNG
(6-(3-Hexyloxy-pyrazin-2-yl)-1-methyl-2,3,4,7-tetra...)
Show SMILES CCCCCCOc1nccnc1C1=CCCCN(C)C1 |t:14|
Show InChI InChI=1S/C17H27N3O/c1-3-4-5-8-13-21-17-16(18-10-11-19-17)15-9-6-7-12-20(2)14-15/h9-11H,3-8,12-14H2,1-2H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033156
PNG
((S)-6-(3-Hexyloxy-pyrazin-2-yl)-1-aza-bicyclo[3.2....)
Show SMILES CCCCCCOc1nccnc1[C@@H]1CN2CC1CCC2 |THB:12:13:16:20.18.19|
Show InChI InChI=1S/C17H27N3O/c1-2-3-4-5-11-21-17-16(18-8-9-19-17)15-13-20-10-6-7-14(15)12-20/h8-9,14-15H,2-7,10-13H2,1H3/t14?,15-/m1/s1
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]-Pz as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50033145
PNG
(6-(3-Hexyloxy-pyrazin-2-yl)-2,3,4,7-tetrahydro-1H-...)
Show SMILES CCCCCCOc1nccnc1C1=CCCCNC1 |t:14|
Show InChI InChI=1S/C16H25N3O/c1-2-3-4-7-12-20-16-15(18-10-11-19-16)14-8-5-6-9-17-13-14/h8,10-11,17H,2-7,9,12-13H2,1H3
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Lilly Research Laboratories

Curated by ChEMBL


Assay Description
Binding activity against muscarinic acetylcholine receptor M1 in rat brain, using [3H]OXO-M as the radioligand.


J Med Chem 38: 3469-81 (1995)


BindingDB Entry DOI: 10.7270/Q2TB17JZ
More data for this
Ligand-Target Pair
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