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Compile Data Set for Download or QSAR

Found 122 hits with Last Name = 'clark' and Initial = 'ms'   
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


(RAT)
BDBM50229528
PNG
(CHEMBL93406)
Show SMILES [H][C@]12CC[N@](C[C@H]1c1nc(C)no1)C2
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n/an/a 2.80n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM10759
PNG
(2-acetoxyethyl(trimethyl)ammonium;bromide | 2-acet...)
Show SMILES CC(=O)OCC[N+](C)(C)C
Show InChI InChI=1S/C7H16NO2/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3/q+1
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n/an/a 12n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM10759
PNG
(2-acetoxyethyl(trimethyl)ammonium;bromide | 2-acet...)
Show SMILES CC(=O)OCC[N+](C)(C)C
Show InChI InChI=1S/C7H16NO2/c1-7(9)10-6-5-8(2,3)4/h5-6H2,1-4H3/q+1
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n/an/a 12n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50005677
PNG
(CHEMBL23957 | OXO-M | Trimethyl-[4-(2-oxo-pyrrolid...)
Show SMILES C[N+](C)(C)CC#CCN1CCCC1=O
Show InChI InChI=1S/C11H19N2O/c1-13(2,3)10-5-4-8-12-9-6-7-11(12)14/h6-10H2,1-3H3/q+1
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n/an/a 13n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229526
PNG
(CHEMBL279356)
Show SMILES Cc1noc(n1)C1CN2CCC1CC2 |(5.41,-5.22,;4.1,-6,;4.34,-7.52,;2.94,-8.22,;1.87,-7.15,;2.56,-5.75,;.54,-7.93,;.54,-9.47,;-.8,-10.25,;-2.11,-9.47,;-2.11,-7.93,;-.8,-7.16,;-1.21,-8.65,;-.19,-8.97,)|
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n/an/a 14n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229526
PNG
(CHEMBL279356)
Show SMILES Cc1noc(n1)C1CN2CCC1CC2 |(5.41,-5.22,;4.1,-6,;4.34,-7.52,;2.94,-8.22,;1.87,-7.15,;2.56,-5.75,;.54,-7.93,;.54,-9.47,;-.8,-10.25,;-2.11,-9.47,;-2.11,-7.93,;-.8,-7.16,;-1.21,-8.65,;-.19,-8.97,)|
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n/an/a 14n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229524
PNG
(CHEMBL329351)
Show SMILES Cc1noc(n1)C12CCN(C1)CCC2
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n/an/a 15n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50004665
PNG
((oxotremorine)1-(4-Pyrrolidin-1-yl-but-2-ynyl)-pyr...)
Show SMILES O=C1CCCN1CC#CCN1CCCC1
Show InChI InChI=1S/C12H18N2O/c15-12-6-5-11-14(12)10-4-3-9-13-7-1-2-8-13/h1-2,5-11H2
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n/an/a 17n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229530
PNG
(CHEMBL329434)
Show SMILES COC(=O)C12CCN(C1)CCC2
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n/an/a 19n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229520
PNG
(CHEMBL93430)
Show SMILES [H][C@]12CC[N@@](C1)C[C@@H](C2)c1nc(C)no1
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n/an/a 28n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50061707
PNG
((1-Aza-bicyclo[3.2.1]oct-5-yl)-[(Z)-methoxyimino]-...)
Show SMILES CO\N=C(/C#N)C12CCN(C1)CCC2
Show InChI InChI=1S/C10H15N3O/c1-14-12-9(7-11)10-3-2-5-13(8-10)6-4-10/h2-6,8H2,1H3/b12-9+
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n/an/a 28n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidynyl benzylate (QNB)radioligand in human cloned Muscarinic acetylcholine receptor M3


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229691
PNG
(CHEMBL23118)
Show SMILES Cc1nnn(n1)C1CN2CCC1CC2 |(18.11,-12.96,;17.7,-14.41,;18.77,-15.8,;17.57,-17.13,;16.17,-16.52,;16.34,-14.95,;14.82,-17.27,;14.82,-18.82,;13.48,-19.48,;12.16,-18.82,;12.16,-17.27,;13.46,-16.5,;13.87,-17.98,;12.85,-18.33,)|
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n/an/a 30n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50061707
PNG
((1-Aza-bicyclo[3.2.1]oct-5-yl)-[(Z)-methoxyimino]-...)
Show SMILES CO\N=C(/C#N)C12CCN(C1)CCC2
Show InChI InChI=1S/C10H15N3O/c1-14-12-9(7-11)10-3-2-5-13(8-10)6-4-10/h2-6,8H2,1H3/b12-9+
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n/an/a 31n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidinyl benzilate (QNB) as radioligand in human cloned Muscarinic acetylcholine receptor ...


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229527
PNG
(CHEMBL94072)
Show SMILES Cc1nnc(o1)C12CCN(C1)CCC2
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n/an/a 42n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229535
PNG
(CHEMBL91390)
Show SMILES [H][C@@]12C[N@@](C[C@H]1c1nc(C)no1)CCC2
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n/an/a 44n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229533
PNG
(CHEMBL330709)
Show SMILES COC(=O)C12CCN(CC1)C2
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n/an/a 48n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229697
PNG
(CHEMBL23721)
Show SMILES Cn1ncc(n1)C1CN2CCC1CC2 |(18.33,-12.98,;17.57,-14.14,;18.65,-15.55,;17.46,-16.88,;16.04,-16.24,;16.2,-14.7,;14.7,-17.02,;14.7,-18.55,;13.34,-19.21,;12.03,-18.55,;12.03,-17.02,;13.35,-16.24,;13.75,-17.74,;12.73,-18.07,)|
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n/an/a 48n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50061707
PNG
((1-Aza-bicyclo[3.2.1]oct-5-yl)-[(Z)-methoxyimino]-...)
Show SMILES CO\N=C(/C#N)C12CCN(C1)CCC2
Show InChI InChI=1S/C10H15N3O/c1-14-12-9(7-11)10-3-2-5-13(8-10)6-4-10/h2-6,8H2,1H3/b12-9+
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n/an/a 49n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, usingquinuclidynyl benzylate (QNB) radioligand in human cloned Muscarinic acetylcholine receptor M4


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50061705
PNG
((R)-1-Aza-bicyclo[2.2.2]oct-3-yl-[(Z)-methoxyimino...)
Show SMILES CO\N=C(/C#N)[C@H]1CN2CCC1CC2 |wU:6.5,(10.77,-7.56,;9.23,-7.56,;8.14,-8.66,;8.14,-10.2,;9.41,-10.96,;10.69,-11.69,;6.8,-10.98,;6.8,-12.53,;5.46,-13.28,;4.14,-12.53,;4.14,-10.98,;5.46,-10.2,;4.95,-11.51,;5.89,-12.1,)|
Show InChI InChI=1S/C10H15N3O/c1-14-12-10(6-11)9-7-13-4-2-8(9)3-5-13/h8-9H,2-5,7H2,1H3/b12-10+/t9-/m0/s1
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n/an/a 60n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidynyl benzylate (QNB) as radioligand in human cloned Muscarinic acetylcholine receptor ...


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229618
PNG
(CHEMBL23335)
Show SMILES Cc1ncn(n1)C1CN2CCC1CC2 |(17.8,-12.62,;17.41,-14.06,;18.48,-15.44,;17.28,-16.78,;15.88,-16.13,;16.04,-14.6,;14.52,-16.91,;14.52,-18.45,;13.19,-19.11,;11.88,-18.45,;11.88,-16.91,;13.19,-16.13,;13.59,-17.62,;12.57,-17.96,)|
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n/an/a 75n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229536
PNG
(CHEMBL329321)
Show SMILES [H][C@]12CC[N@@](C1)C[C@@H](C2)C(=O)OC
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n/an/a 77n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50061705
PNG
((R)-1-Aza-bicyclo[2.2.2]oct-3-yl-[(Z)-methoxyimino...)
Show SMILES CO\N=C(/C#N)[C@H]1CN2CCC1CC2 |wU:6.5,(10.77,-7.56,;9.23,-7.56,;8.14,-8.66,;8.14,-10.2,;9.41,-10.96,;10.69,-11.69,;6.8,-10.98,;6.8,-12.53,;5.46,-13.28,;4.14,-12.53,;4.14,-10.98,;5.46,-10.2,;4.95,-11.51,;5.89,-12.1,)|
Show InChI InChI=1S/C10H15N3O/c1-14-12-10(6-11)9-7-13-4-2-8(9)3-5-13/h8-9H,2-5,7H2,1H3/b12-10+/t9-/m0/s1
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n/an/a 90n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidynyl benzylate (QNB) as radioligand in human cloned Muscarinic acetylcholine receptor ...


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229539
PNG
(CHEMBL93126)
Show SMILES [H][C@]12CC[N@](C[C@H]1c1noc(C)n1)C2
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n/an/a 92n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50061707
PNG
((1-Aza-bicyclo[3.2.1]oct-5-yl)-[(Z)-methoxyimino]-...)
Show SMILES CO\N=C(/C#N)C12CCN(C1)CCC2
Show InChI InChI=1S/C10H15N3O/c1-14-12-9(7-11)10-3-2-5-13(8-10)6-4-10/h2-6,8H2,1H3/b12-9+
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n/an/a 99n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity against human Muscarinic acetylcholine receptor M1 using quinuclidynyl benzylate (QNB)


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM46858
PNG
(1-methyl-3,6-dihydro-2H-pyridine-5-carboxylic acid...)
Show SMILES COC(=O)C1=CCCN(C)C1 |t:4|
Show InChI InChI=1S/C8H13NO2/c1-9-5-3-4-7(6-9)8(10)11-2/h4H,3,5-6H2,1-2H3
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n/an/a 115n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229531
PNG
(CHEMBL328152)
Show SMILES [H][C@]12CC[N@](C[C@H]1c1nnc(C)o1)C2
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n/an/a 120n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229538
PNG
(CHEMBL91907)
Show SMILES Cc1noc(n1)C12CCN(CC1)C2
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n/an/a 130n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229522
PNG
(CHEMBL329316)
Show SMILES [H][C@@]12CCC[N@](C[C@@H](C1)C(=O)OC)C2
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n/an/a 130n/an/an/an/an/an/a



SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229688
PNG
(CHEMBL276975)
Show SMILES Cn1nnc(n1)C1CN2CCC1CC2 |(18.04,-12.91,;17.63,-14.36,;18.7,-15.74,;17.5,-17.06,;16.11,-16.45,;16.28,-14.89,;14.77,-17.21,;14.77,-18.75,;13.43,-19.41,;12.11,-18.75,;12.11,-17.21,;13.41,-16.43,;13.82,-17.91,;12.8,-18.26,)|
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(Homo sapiens (Human))
BDBM50061705
PNG
((R)-1-Aza-bicyclo[2.2.2]oct-3-yl-[(Z)-methoxyimino...)
Show SMILES CO\N=C(/C#N)[C@H]1CN2CCC1CC2 |wU:6.5,(10.77,-7.56,;9.23,-7.56,;8.14,-8.66,;8.14,-10.2,;9.41,-10.96,;10.69,-11.69,;6.8,-10.98,;6.8,-12.53,;5.46,-13.28,;4.14,-12.53,;4.14,-10.98,;5.46,-10.2,;4.95,-11.51,;5.89,-12.1,)|
Show InChI InChI=1S/C10H15N3O/c1-14-12-10(6-11)9-7-13-4-2-8(9)3-5-13/h8-9H,2-5,7H2,1H3/b12-10+/t9-/m0/s1
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity against human Muscarinic acetylcholine receptor M1 using quinuclidynyl benzylate (QNB)


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50230645
PNG
(CHEMBL434772)
Show SMILES Cc1cnn(n1)C1CN2CCC1CC2 |(18.13,-12.97,;17.74,-14.43,;18.81,-15.82,;17.59,-17.15,;16.19,-16.54,;16.36,-14.97,;14.84,-17.3,;14.84,-18.84,;13.5,-19.51,;12.17,-18.84,;12.17,-17.3,;13.5,-16.52,;13.89,-18,;12.87,-18.35,)|
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229525
PNG
(CHEMBL94065)
Show SMILES Cc1nnc(o1)C12CCN(CC1)C2
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50061705
PNG
((R)-1-Aza-bicyclo[2.2.2]oct-3-yl-[(Z)-methoxyimino...)
Show SMILES CO\N=C(/C#N)[C@H]1CN2CCC1CC2 |wU:6.5,(10.77,-7.56,;9.23,-7.56,;8.14,-8.66,;8.14,-10.2,;9.41,-10.96,;10.69,-11.69,;6.8,-10.98,;6.8,-12.53,;5.46,-13.28,;4.14,-12.53,;4.14,-10.98,;5.46,-10.2,;4.95,-11.51,;5.89,-12.1,)|
Show InChI InChI=1S/C10H15N3O/c1-14-12-10(6-11)9-7-13-4-2-8(9)3-5-13/h8-9H,2-5,7H2,1H3/b12-10+/t9-/m0/s1
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidynyl benzylate (QNB) as radioligand in human cloned Muscarinic acetylcholine receptor ...


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM39341
PNG
(11-[(4-methylpiperazin-1-yl)acetyl]-5,11-dihydro-6...)
Show SMILES CN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C19H21N5O2/c1-22-9-11-23(12-10-22)13-17(25)24-16-7-3-2-5-14(16)19(26)21-15-6-4-8-20-18(15)24/h2-8H,9-13H2,1H3,(H,21,26)
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50061702
PNG
((1R,3R,4R)-1-Aza-bicyclo[2.2.1]heptane-3-carbaldeh...)
Show SMILES CO\N=C\[C@H]1C[N@@]2CC[C@H]1C2
Show InChI InChI=1S/C8H14N2O/c1-11-9-4-8-6-10-3-2-7(8)5-10/h4,7-8H,2-3,5-6H2,1H3/b9-4+/t7-,8-/m0/s1
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidynyl benzylate (QNB) as radioligand in human cloned Muscarinic acetylcholine receptor ...


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229532
PNG
(CHEMBL445119)
Show SMILES [H][C@]12CC[N@](C[C@H]1C(=O)OC)C2
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229667
PNG
(CHEMBL23563)
Show SMILES C1CN2CCC1C(C2)n1ncnn1 |(12.18,-16.59,;12.18,-18.13,;13.51,-18.81,;12.88,-17.66,;13.9,-17.31,;13.49,-15.8,;14.85,-16.59,;14.85,-18.13,;16.2,-15.82,;16.37,-14.27,;17.73,-13.71,;18.81,-15.11,;17.61,-16.47,)|
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50061706
PNG
((1-Aza-bicyclo[2.2.1]hept-4-yl)-[(Z)-methoxyimino]...)
Show SMILES CO\N=C(/C#N)C12CCN(CC1)C2
Show InChI InChI=1S/C9H13N3O/c1-13-11-8(6-10)9-2-4-12(7-9)5-3-9/h2-5,7H2,1H3/b11-8+
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidynyl benzylate (QNB) as radioligand in human cloned Muscarinic acetylcholine receptor ...


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229537
PNG
(CHEMBL328497)
Show SMILES Cc1nc(no1)C12CCN(C1)CCC2
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229521
PNG
(CHEMBL91850)
Show SMILES [H][C@@]12CCC[N@](C[C@@H](C1)c1nc(C)no1)C2
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50061706
PNG
((1-Aza-bicyclo[2.2.1]hept-4-yl)-[(Z)-methoxyimino]...)
Show SMILES CO\N=C(/C#N)C12CCN(CC1)C2
Show InChI InChI=1S/C9H13N3O/c1-13-11-8(6-10)9-2-4-12(7-9)5-3-9/h2-5,7H2,1H3/b11-8+
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidynyl benzylate (QNB) as radioligand in human cloned Muscarinic acetylcholine receptor ...


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM39341
PNG
(11-[(4-methylpiperazin-1-yl)acetyl]-5,11-dihydro-6...)
Show SMILES CN1CCN(CC(=O)N2c3ccccc3C(=O)Nc3cccnc23)CC1
Show InChI InChI=1S/C19H21N5O2/c1-22-9-11-23(12-10-22)13-17(25)24-16-7-3-2-5-14(16)19(26)21-15-6-4-8-20-18(15)24/h2-8H,9-13H2,1H3,(H,21,26)
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(Homo sapiens (Human))
BDBM50061719
PNG
((1R,3R,4R)-1-Aza-bicyclo[2.2.1]hept-3-yl-[(Z)-meth...)
Show SMILES CO\N=C(/C#N)[C@H]1C[N@@]2CC[C@H]1C2
Show InChI InChI=1S/C9H13N3O/c1-13-11-9(4-10)8-6-12-3-2-7(8)5-12/h7-8H,2-3,5-6H2,1H3/b11-9+/t7-,8-/m0/s1
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidynyl benzylate (QNB) as radioligand in human cloned Muscarinic acetylcholine receptor ...


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50230639
PNG
(CHEMBL23172)
Show SMILES C1CN2CCC1C(C2)n1cncn1 |(-.97,-5.52,;-.97,-7.06,;.35,-7.74,;-.27,-6.59,;.76,-6.24,;.35,-4.74,;1.7,-5.52,;1.7,-7.06,;3.06,-4.76,;4.47,-5.38,;5.68,-4.04,;4.6,-2.65,;3.23,-3.19,)|
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50061706
PNG
((1-Aza-bicyclo[2.2.1]hept-4-yl)-[(Z)-methoxyimino]...)
Show SMILES CO\N=C(/C#N)C12CCN(CC1)C2
Show InChI InChI=1S/C9H13N3O/c1-13-11-8(6-10)9-2-4-12(7-9)5-3-9/h2-5,7H2,1H3/b11-8+
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidynyl benzylate (QNB) as radioligand in human cloned Muscarinic acetylcholine receptor ...


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50212556
PNG
(CHEMBL14648)
Show SMILES COC(=O)C1CN2CCC1CC2 |(14.24,-8.88,;14.24,-7.38,;13.17,-6.31,;13.15,-4.81,;11.84,-7.09,;11.84,-8.63,;10.5,-9.41,;11.11,-8.13,;10.09,-7.8,;10.5,-6.32,;9.19,-7.09,;9.19,-8.63,)|
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 34: 2726-35 (1991)


BindingDB Entry DOI: 10.7270/Q2BG2R7J
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50061719
PNG
((1R,3R,4R)-1-Aza-bicyclo[2.2.1]hept-3-yl-[(Z)-meth...)
Show SMILES CO\N=C(/C#N)[C@H]1C[N@@]2CC[C@H]1C2
Show InChI InChI=1S/C9H13N3O/c1-13-11-9(4-10)8-6-12-3-2-7(8)5-12/h7-8H,2-3,5-6H2,1H3/b11-9+/t7-,8-/m0/s1
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidynyl benzylate (QNB) as radioligand in human cloned Muscarinic acetylcholine receptor ...


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M2


(Homo sapiens (Human))
BDBM50061710
PNG
((1R,3S,4R)-1-Aza-bicyclo[2.2.1]hept-3-yl-[(Z)-meth...)
Show SMILES CO\N=C(/C#N)[C@@H]1C[N@@]2CC[C@H]1C2
Show InChI InChI=1S/C9H13N3O/c1-13-11-9(4-10)8-6-12-3-2-7(8)5-12/h7-8H,2-3,5-6H2,1H3/b11-9+/t7-,8+/m0/s1
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidynyl benzylate (QNB) as radioligand in human cloned Muscarinic acetylcholine receptor ...


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M4


(Homo sapiens (Human))
BDBM50061719
PNG
((1R,3R,4R)-1-Aza-bicyclo[2.2.1]hept-3-yl-[(Z)-meth...)
Show SMILES CO\N=C(/C#N)[C@H]1C[N@@]2CC[C@H]1C2
Show InChI InChI=1S/C9H13N3O/c1-13-11-9(4-10)8-6-12-3-2-7(8)5-12/h7-8H,2-3,5-6H2,1H3/b11-9+/t7-,8-/m0/s1
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL


Assay Description
In vitro affinity of the compound is evaluated, using quinuclidynyl benzylate (QNB) as radioligand in human cloned Muscarinic acetylcholine receptor ...


J Med Chem 40: 4265-80 (1998)


Article DOI: 10.1021/jm9702903
BindingDB Entry DOI: 10.7270/Q2S46R2D
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50230644
PNG
(CHEMBL429230)
Show SMILES Cn1nncc1C1CN2CCC1CC2 |(15.08,-13.46,;16.28,-14.36,;17.63,-13.81,;18.7,-15.2,;17.5,-16.53,;16.11,-15.9,;14.77,-16.65,;14.77,-18.19,;13.43,-18.86,;12.11,-18.19,;12.11,-16.65,;13.41,-15.89,;13.82,-17.38,;12.8,-17.71,)|
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SmithKline Beecham Pharmaceuticals

Curated by ChEMBL




J Med Chem 35: 1280-90 (1992)


BindingDB Entry DOI: 10.7270/Q2G1632Q
More data for this
Ligand-Target Pair
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