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Compile Data Set for Download or QSAR

Found 475 hits with Last Name = 'he' and Initial = 'xc'   
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)
BDBM50403547
PNG
(ATROPEN | ATROPINE)
Show SMILES CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)c1ccccc1 |r,THB:9:7:1:3.4|
Show InChI InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15+,16?
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0.337n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50453183
PNG
(CHEMBL2114060)
Show SMILES CN1CC2CC1C[C@H]2OC(=O)C(C)(c1ccccc1)c1ccccc1 |r,THB:8:7:1.2:4,0:1:7.6:4|
Show InChI InChI=1S/C22H25NO2/c1-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(24)25-20-14-19-13-16(20)15-23(19)2/h3-12,16,19-20H,13-15H2,1-2H3/t16?,19?,20-/m1/s1
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0.423n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M1 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50403547
PNG
(ATROPEN | ATROPINE)
Show SMILES CN1[C@H]2CC[C@@H]1C[C@@H](C2)OC(=O)C(CO)c1ccccc1 |r,THB:9:7:1:3.4|
Show InChI InChI=1S/C17H23NO3/c1-18-13-7-8-14(18)10-15(9-13)21-17(20)16(11-19)12-5-3-2-4-6-12/h2-6,13-16,19H,7-11H2,1H3/t13-,14+,15+,16?
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0.459n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)
BDBM50453183
PNG
(CHEMBL2114060)
Show SMILES CN1CC2CC1C[C@H]2OC(=O)C(C)(c1ccccc1)c1ccccc1 |r,THB:8:7:1.2:4,0:1:7.6:4|
Show InChI InChI=1S/C22H25NO2/c1-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(24)25-20-14-19-13-16(20)15-23(19)2/h3-12,16,19-20H,13-15H2,1-2H3/t16?,19?,20-/m1/s1
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0.522n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M3 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)
BDBM50453188
PNG
(CHEMBL2115124)
Show SMILES CN1CC2CC1C[C@@H]2OC(=O)C(C)(c1ccccc1)c1ccccc1 |r,THB:8:7:1.2:4,0:1:7.6:4|
Show InChI InChI=1S/C22H25NO2/c1-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(24)25-20-14-19-13-16(20)15-23(19)2/h3-12,16,19-20H,13-15H2,1-2H3/t16?,19?,20-/m0/s1
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0.533n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M3 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50453188
PNG
(CHEMBL2115124)
Show SMILES CN1CC2CC1C[C@@H]2OC(=O)C(C)(c1ccccc1)c1ccccc1 |r,THB:8:7:1.2:4,0:1:7.6:4|
Show InChI InChI=1S/C22H25NO2/c1-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(24)25-20-14-19-13-16(20)15-23(19)2/h3-12,16,19-20H,13-15H2,1-2H3/t16?,19?,20-/m0/s1
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0.876n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M1 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453183
PNG
(CHEMBL2114060)
Show SMILES CN1CC2CC1C[C@H]2OC(=O)C(C)(c1ccccc1)c1ccccc1 |r,THB:8:7:1.2:4,0:1:7.6:4|
Show InChI InChI=1S/C22H25NO2/c1-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(24)25-20-14-19-13-16(20)15-23(19)2/h3-12,16,19-20H,13-15H2,1-2H3/t16?,19?,20-/m1/s1
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1.20n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50453182
PNG
(CHEMBL2114061)
Show SMILES CN1CC2C[C@H](OC(=O)C(C)(c3ccccc3)c3ccccc3)C1C2 |r,TLB:6:5:1.2:24,0:1:5.4:24|
Show InChI InChI=1S/C22H25NO2/c1-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(24)25-20-14-16-13-19(20)23(2)15-16/h3-12,16,19-20H,13-15H2,1-2H3/t16?,19?,20-/m0/s1
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2.20n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M1 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)
BDBM50453182
PNG
(CHEMBL2114061)
Show SMILES CN1CC2C[C@H](OC(=O)C(C)(c3ccccc3)c3ccccc3)C1C2 |r,TLB:6:5:1.2:24,0:1:5.4:24|
Show InChI InChI=1S/C22H25NO2/c1-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(24)25-20-14-16-13-19(20)23(2)15-16/h3-12,16,19-20H,13-15H2,1-2H3/t16?,19?,20-/m0/s1
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4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M3 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453188
PNG
(CHEMBL2115124)
Show SMILES CN1CC2CC1C[C@@H]2OC(=O)C(C)(c1ccccc1)c1ccccc1 |r,THB:8:7:1.2:4,0:1:7.6:4|
Show InChI InChI=1S/C22H25NO2/c1-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(24)25-20-14-19-13-16(20)15-23(19)2/h3-12,16,19-20H,13-15H2,1-2H3/t16?,19?,20-/m0/s1
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4.10n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50453186
PNG
(CHEMBL2115125)
Show SMILES CN1CC2C[C@@H](OC(=O)C(C)(c3ccccc3)c3ccccc3)C1C2 |r,TLB:6:5:1.2:24,0:1:5.4:24|
Show InChI InChI=1S/C22H25NO2/c1-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(24)25-20-14-16-13-19(20)23(2)15-16/h3-12,16,19-20H,13-15H2,1-2H3/t16?,19?,20-/m1/s1
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5.30n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M1 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453182
PNG
(CHEMBL2114061)
Show SMILES CN1CC2C[C@H](OC(=O)C(C)(c3ccccc3)c3ccccc3)C1C2 |r,TLB:6:5:1.2:24,0:1:5.4:24|
Show InChI InChI=1S/C22H25NO2/c1-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(24)25-20-14-16-13-19(20)23(2)15-16/h3-12,16,19-20H,13-15H2,1-2H3/t16?,19?,20-/m0/s1
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6.10n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)
BDBM50453186
PNG
(CHEMBL2115125)
Show SMILES CN1CC2C[C@@H](OC(=O)C(C)(c3ccccc3)c3ccccc3)C1C2 |r,TLB:6:5:1.2:24,0:1:5.4:24|
Show InChI InChI=1S/C22H25NO2/c1-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(24)25-20-14-16-13-19(20)23(2)15-16/h3-12,16,19-20H,13-15H2,1-2H3/t16?,19?,20-/m1/s1
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8.30n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M3 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50004656
PNG
((2-Carbamoyloxy-ethyl)-trimethyl-ammonium | (2-Car...)
Show SMILES C[N+](C)(C)CCOC(N)=O
Show InChI InChI=1S/C6H14N2O2/c1-8(2,3)4-5-10-6(7)9/h4-5H2,1-3H3,(H-,7,9)/p+1
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13n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453186
PNG
(CHEMBL2115125)
Show SMILES CN1CC2C[C@@H](OC(=O)C(C)(c3ccccc3)c3ccccc3)C1C2 |r,TLB:6:5:1.2:24,0:1:5.4:24|
Show InChI InChI=1S/C22H25NO2/c1-22(17-9-5-3-6-10-17,18-11-7-4-8-12-18)21(24)25-20-14-16-13-19(20)23(2)15-16/h3-12,16,19-20H,13-15H2,1-2H3/t16?,19?,20-/m1/s1
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20n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50229584
PNG
(PILOCARBINE)
Show SMILES [H][C@@]1(CC)C(=O)OC[C@]1([H])c1cncn1C
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83n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM10441
PNG
((+)-Huperzine A | (+/-)Huperzine A | (-)-Huperzine...)
Show SMILES C\C=C1/C2Cc3[nH]c(=O)ccc3C1(N)CC(C)=C2 |c:18,TLB:10:11:2:17.15.14,THB:1:2:4.5.11:17.15.14|
Show InChI InChI=1S/C15H18N2O/c1-3-11-10-6-9(2)8-15(11,16)12-4-5-14(18)17-13(12)7-10/h3-6,10H,7-8,16H2,1-2H3,(H,17,18)/b11-3+
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175 -38.6n/an/an/an/an/a7.025



Weizmann Institute of Science



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. Enzyme activity was determined by measuring the absorbance at ...


Biochemistry 41: 10810-8 (2002)


Article DOI: 10.1021/jm800936s
BindingDB Entry DOI: 10.7270/Q2HQ3X52
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Muscarinic acetylcholine receptor


(RAT)
BDBM50453184
PNG
(CHEMBL2115122)
Show SMILES CN1CC2CC1C[C@@H]2OC(C)=O |r,TLB:8:7:1.2:4,THB:0:1:7.6:4|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-8-3-7(9)5-10(8)2/h7-9H,3-5H2,1-2H3/t7?,8?,9-/m0/s1
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230n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM10632
PNG
((-)-Huperzine B | (1R,10R)-16-methyl-6,14-diazatet...)
Show SMILES CC1=CC2Cc3[nH]c(=O)ccc3[C@]3(C1)NCCC[C@H]23 |r,t:1,TLB:17:18:4.5.11:2.1.13,THB:10:11:18:2.1.13|
Show InChI InChI=1S/C16H20N2O/c1-10-7-11-8-14-13(4-5-15(19)18-14)16(9-10)12(11)3-2-6-17-16/h4-5,7,11-12,17H,2-3,6,8-9H2,1H3,(H,18,19)/t11?,12-,16-/m1/s1
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334 -37.0n/an/an/an/an/a7.025



Weizmann Institute of Science



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. Enzyme activity was determined by measuring the absorbance at ...


Biochemistry 41: 10810-8 (2002)


Article DOI: 10.1021/jm800936s
BindingDB Entry DOI: 10.7270/Q2HQ3X52
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Muscarinic acetylcholine receptor


(RAT)
BDBM50229584
PNG
(PILOCARBINE)
Show SMILES [H][C@@]1(CC)C(=O)OC[C@]1([H])c1cncn1C
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1.01E+3n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453189
PNG
(CHEMBL2114058)
Show SMILES CN1CC2CC1C[C@H]2OC(C)=O |r,TLB:8:7:1.2:4,THB:0:1:7.6:4|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-8-3-7(9)5-10(8)2/h7-9H,3-5H2,1-2H3/t7?,8?,9-/m1/s1
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1.43E+3n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50006546
PNG
(Acetic acid 2-benzyl-2-aza-bicyclo[2.2.1]hept-5-yl...)
Show SMILES CC(=O)OC1CC2CC1CN2Cc1ccccc1 |TLB:3:4:10.9:7,11:10:4.5:7|
Show InChI InChI=1S/C15H19NO2/c1-11(17)18-15-8-14-7-13(15)10-16(14)9-12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3
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1.56E+3n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50453187
PNG
(CHEMBL2115123)
Show SMILES CC(=O)O[C@@H]1CC2CC1N(Cc1ccccc1)C2 |r,TLB:3:4:9.17:7,10:9:4.5:7|
Show InChI InChI=1S/C15H19NO2/c1-11(17)18-15-8-13-7-14(15)16(10-13)9-12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3/t13?,14?,15-/m1/s1
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2.26E+3n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M1 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453187
PNG
(CHEMBL2115123)
Show SMILES CC(=O)O[C@@H]1CC2CC1N(Cc1ccccc1)C2 |r,TLB:3:4:9.17:7,10:9:4.5:7|
Show InChI InChI=1S/C15H19NO2/c1-11(17)18-15-8-13-7-14(15)16(10-13)9-12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3/t13?,14?,15-/m1/s1
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2.57E+3n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Tetronarce californica (Pacific electric ray) (Tor...)
BDBM10441
PNG
((+)-Huperzine A | (+/-)Huperzine A | (-)-Huperzine...)
Show SMILES C\C=C1/C2Cc3[nH]c(=O)ccc3C1(N)CC(C)=C2 |c:18,TLB:10:11:2:17.15.14,THB:1:2:4.5.11:17.15.14|
Show InChI InChI=1S/C15H18N2O/c1-3-11-10-6-9(2)8-15(11,16)12-4-5-14(18)17-13(12)7-10/h3-6,10H,7-8,16H2,1-2H3,(H,17,18)/b11-3+
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4.30E+3 -30.6n/an/an/an/an/a7.025



Weizmann Institute of Science



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. Enzyme activity was determined by measuring the absorbance at ...


Biochemistry 41: 10810-8 (2002)


Article DOI: 10.1021/jm800936s
BindingDB Entry DOI: 10.7270/Q2HQ3X52
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Muscarinic acetylcholine receptor


(RAT)
BDBM50006549
PNG
(Acetic acid 2-methyl-2-aza-bicyclo[2.2.1]hept-6-yl...)
Show SMILES CN1CC2CC(OC(C)=O)C1C2 |TLB:0:1:5.4:11,THB:6:5:1.2:11|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-7-3-8(9)10(2)5-7/h7-9H,3-5H2,1-2H3
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5.37E+3n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453190
PNG
(CHEMBL2114059)
Show SMILES CC(=O)O[C@H]1CC2CC1N(Cc1ccccc1)C2 |r,TLB:3:4:9.17:7,10:9:4.5:7|
Show InChI InChI=1S/C15H19NO2/c1-11(17)18-15-8-13-7-14(15)16(10-13)9-12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3/t13?,14?,15-/m0/s1
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6.63E+3n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50453190
PNG
(CHEMBL2114059)
Show SMILES CC(=O)O[C@H]1CC2CC1N(Cc1ccccc1)C2 |r,TLB:3:4:9.17:7,10:9:4.5:7|
Show InChI InChI=1S/C15H19NO2/c1-11(17)18-15-8-13-7-14(15)16(10-13)9-12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3/t13?,14?,15-/m0/s1
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7.01E+3n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M1 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453190
PNG
(CHEMBL2114059)
Show SMILES CC(=O)O[C@H]1CC2CC1N(Cc1ccccc1)C2 |r,TLB:3:4:9.17:7,10:9:4.5:7|
Show InChI InChI=1S/C15H19NO2/c1-11(17)18-15-8-13-7-14(15)16(10-13)9-12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3/t13?,14?,15-/m0/s1
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7.21E+3n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453184
PNG
(CHEMBL2115122)
Show SMILES CN1CC2CC1C[C@@H]2OC(C)=O |r,TLB:8:7:1.2:4,THB:0:1:7.6:4|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-8-3-7(9)5-10(8)2/h7-9H,3-5H2,1-2H3/t7?,8?,9-/m0/s1
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9.84E+3n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453184
PNG
(CHEMBL2115122)
Show SMILES CN1CC2CC1C[C@@H]2OC(C)=O |r,TLB:8:7:1.2:4,THB:0:1:7.6:4|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-8-3-7(9)5-10(8)2/h7-9H,3-5H2,1-2H3/t7?,8?,9-/m0/s1
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1.01E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50006546
PNG
(Acetic acid 2-benzyl-2-aza-bicyclo[2.2.1]hept-5-yl...)
Show SMILES CC(=O)OC1CC2CC1CN2Cc1ccccc1 |TLB:3:4:10.9:7,11:10:4.5:7|
Show InChI InChI=1S/C15H19NO2/c1-11(17)18-15-8-14-7-13(15)10-16(14)9-12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3
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1.03E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453189
PNG
(CHEMBL2114058)
Show SMILES CN1CC2CC1C[C@H]2OC(C)=O |r,TLB:8:7:1.2:4,THB:0:1:7.6:4|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-8-3-7(9)5-10(8)2/h7-9H,3-5H2,1-2H3/t7?,8?,9-/m1/s1
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1.15E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)
BDBM50453184
PNG
(CHEMBL2115122)
Show SMILES CN1CC2CC1C[C@@H]2OC(C)=O |r,TLB:8:7:1.2:4,THB:0:1:7.6:4|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-8-3-7(9)5-10(8)2/h7-9H,3-5H2,1-2H3/t7?,8?,9-/m0/s1
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1.20E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M3 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50006546
PNG
(Acetic acid 2-benzyl-2-aza-bicyclo[2.2.1]hept-5-yl...)
Show SMILES CC(=O)OC1CC2CC1CN2Cc1ccccc1 |TLB:3:4:10.9:7,11:10:4.5:7|
Show InChI InChI=1S/C15H19NO2/c1-11(17)18-15-8-14-7-13(15)10-16(14)9-12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3
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1.48E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453190
PNG
(CHEMBL2114059)
Show SMILES CC(=O)O[C@H]1CC2CC1N(Cc1ccccc1)C2 |r,TLB:3:4:9.17:7,10:9:4.5:7|
Show InChI InChI=1S/C15H19NO2/c1-11(17)18-15-8-13-7-14(15)16(10-13)9-12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3/t13?,14?,15-/m0/s1
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1.51E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453187
PNG
(CHEMBL2115123)
Show SMILES CC(=O)O[C@@H]1CC2CC1N(Cc1ccccc1)C2 |r,TLB:3:4:9.17:7,10:9:4.5:7|
Show InChI InChI=1S/C15H19NO2/c1-11(17)18-15-8-13-7-14(15)16(10-13)9-12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3/t13?,14?,15-/m1/s1
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1.53E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453189
PNG
(CHEMBL2114058)
Show SMILES CN1CC2CC1C[C@H]2OC(C)=O |r,TLB:8:7:1.2:4,THB:0:1:7.6:4|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-8-3-7(9)5-10(8)2/h7-9H,3-5H2,1-2H3/t7?,8?,9-/m1/s1
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1.74E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50453184
PNG
(CHEMBL2115122)
Show SMILES CN1CC2CC1C[C@@H]2OC(C)=O |r,TLB:8:7:1.2:4,THB:0:1:7.6:4|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-8-3-7(9)5-10(8)2/h7-9H,3-5H2,1-2H3/t7?,8?,9-/m0/s1
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1.75E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M1 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50006549
PNG
(Acetic acid 2-methyl-2-aza-bicyclo[2.2.1]hept-6-yl...)
Show SMILES CN1CC2CC(OC(C)=O)C1C2 |TLB:0:1:5.4:11,THB:6:5:1.2:11|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-7-3-8(9)10(2)5-7/h7-9H,3-5H2,1-2H3
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1.75E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)
BDBM50453190
PNG
(CHEMBL2114059)
Show SMILES CC(=O)O[C@H]1CC2CC1N(Cc1ccccc1)C2 |r,TLB:3:4:9.17:7,10:9:4.5:7|
Show InChI InChI=1S/C15H19NO2/c1-11(17)18-15-8-13-7-14(15)16(10-13)9-12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3/t13?,14?,15-/m0/s1
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1.88E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]QNB binding to m3 receptor transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50004656
PNG
((2-Carbamoyloxy-ethyl)-trimethyl-ammonium | (2-Car...)
Show SMILES C[N+](C)(C)CCOC(N)=O
Show InChI InChI=1S/C6H14N2O2/c1-8(2,3)4-5-10-6(7)9/h4-5H2,1-3H3,(H-,7,9)/p+1
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1.88E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50006546
PNG
(Acetic acid 2-benzyl-2-aza-bicyclo[2.2.1]hept-5-yl...)
Show SMILES CC(=O)OC1CC2CC1CN2Cc1ccccc1 |TLB:3:4:10.9:7,11:10:4.5:7|
Show InChI InChI=1S/C15H19NO2/c1-11(17)18-15-8-14-7-13(15)10-16(14)9-12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3
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1.89E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M1 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50453187
PNG
(CHEMBL2115123)
Show SMILES CC(=O)O[C@@H]1CC2CC1N(Cc1ccccc1)C2 |r,TLB:3:4:9.17:7,10:9:4.5:7|
Show InChI InChI=1S/C15H19NO2/c1-11(17)18-15-8-13-7-14(15)16(10-13)9-12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3/t13?,14?,15-/m1/s1
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2.00E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50006549
PNG
(Acetic acid 2-methyl-2-aza-bicyclo[2.2.1]hept-6-yl...)
Show SMILES CN1CC2CC(OC(C)=O)C1C2 |TLB:0:1:5.4:11,THB:6:5:1.2:11|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-7-3-8(9)10(2)5-7/h7-9H,3-5H2,1-2H3
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2.16E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M1 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50453189
PNG
(CHEMBL2114058)
Show SMILES CN1CC2CC1C[C@H]2OC(C)=O |r,TLB:8:7:1.2:4,THB:0:1:7.6:4|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-8-3-7(9)5-10(8)2/h7-9H,3-5H2,1-2H3/t7?,8?,9-/m1/s1
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2.19E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M1 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor


(RAT)
BDBM50006549
PNG
(Acetic acid 2-methyl-2-aza-bicyclo[2.2.1]hept-6-yl...)
Show SMILES CN1CC2CC(OC(C)=O)C1C2 |TLB:0:1:5.4:11,THB:6:5:1.2:11|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-7-3-8(9)10(2)5-7/h7-9H,3-5H2,1-2H3
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2.49E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL




J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)
BDBM50006546
PNG
(Acetic acid 2-benzyl-2-aza-bicyclo[2.2.1]hept-5-yl...)
Show SMILES CC(=O)OC1CC2CC1CN2Cc1ccccc1 |TLB:3:4:10.9:7,11:10:4.5:7|
Show InChI InChI=1S/C15H19NO2/c1-11(17)18-15-8-14-7-13(15)10-16(14)9-12-5-3-2-4-6-12/h2-6,13-15H,7-10H2,1H3
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2.69E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M3 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)
BDBM50453189
PNG
(CHEMBL2114058)
Show SMILES CN1CC2CC1C[C@H]2OC(C)=O |r,TLB:8:7:1.2:4,THB:0:1:7.6:4|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-8-3-7(9)5-10(8)2/h7-9H,3-5H2,1-2H3/t7?,8?,9-/m1/s1
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UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
2.77E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M3 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M3


(RAT)
BDBM50006549
PNG
(Acetic acid 2-methyl-2-aza-bicyclo[2.2.1]hept-6-yl...)
Show SMILES CN1CC2CC(OC(C)=O)C1C2 |TLB:0:1:5.4:11,THB:6:5:1.2:11|
Show InChI InChI=1S/C9H15NO2/c1-6(11)12-9-4-7-3-8(9)10(2)5-7/h7-9H,3-5H2,1-2H3
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
PubMed
2.80E+4n/an/an/an/an/an/an/an/a



Research Triangle Institute

Curated by ChEMBL


Assay Description
Inhibition of [3H]-QNB binding to Muscarinic acetylcholine receptor M3 transfected with CHO cell


J Med Chem 35: 2184-91 (1992)


BindingDB Entry DOI: 10.7270/Q2B27T74
More data for this
Ligand-Target Pair
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