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Compile Data Set for Download or QSAR

Found 212 hits with Last Name = 'sada' and Initial = 't'   
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)
BDBM50260415
PNG
(4-(2-Chloro-benzenesulfonyl)-2-(1-methyl-1,2,5,6-t...)
Show SMILES CN1CCC=C(C1)C1CN(CCO1)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H21ClN2O3S/c1-18-8-2-3-13(11-18)16-12-19(9-10-22-16)23(20,21)15-6-4-14(17)5-7-15/h3-7,16H,2,8-12H2,1H3
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260n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]Quinuclidinyl benzillate from muscarinic M1 receptor in Wistar rat cortex synaptosomal membrane


Bioorg Med Chem 16: 5157-63 (2008)


Article DOI: 10.1016/j.bmc.2008.03.019
BindingDB Entry DOI: 10.7270/Q26973CD
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50260414
PNG
(4-(4-tert-Butyl-benzenesulfonyl)-2-(1-methyl-1,2,5...)
Show SMILES CN1CCC=C(C1)C1CN(CCO1)S(=O)(=O)c1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C20H30N2O3S/c1-20(2,3)17-7-9-18(10-8-17)26(23,24)22-12-13-25-19(15-22)16-6-5-11-21(4)14-16/h6-10,19H,5,11-15H2,1-4H3
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4.00E+3n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]Quinuclidinyl benzillate from muscarinic M1 receptor in Wistar rat cortex synaptosomal membrane


Bioorg Med Chem 16: 5157-63 (2008)


Article DOI: 10.1016/j.bmc.2008.03.019
BindingDB Entry DOI: 10.7270/Q26973CD
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50260413
PNG
(4-(4-Methyl-benzenesulfonyl)-2-(1-methyl-1,2,5,6-t...)
Show SMILES CN1CCC=C(C1)C1CN(CCO1)S(=O)(=O)c1ccc(C)cc1
Show InChI InChI=1S/C17H24N2O3S/c1-14-5-7-16(8-6-14)23(20,21)19-10-11-22-17(13-19)15-4-3-9-18(2)12-15/h4-8,17H,3,9-13H2,1-2H3
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1.40E+4n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]Quinuclidinyl benzillate from muscarinic M1 receptor in Wistar rat cortex synaptosomal membrane


Bioorg Med Chem 16: 5157-63 (2008)


Article DOI: 10.1016/j.bmc.2008.03.019
BindingDB Entry DOI: 10.7270/Q26973CD
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50300564
PNG
(2-(1-methyl-1,2,5,6-tetrahydropyridin-3-yl)-3-(4-p...)
Show SMILES CN1CCC=C(C1)C1SCC(=O)N1c1ccc(Nc2ccccc2)cc1
Show InChI InChI=1S/C21H23N3OS/c1-23-13-5-6-16(14-23)21-24(20(25)15-26-21)19-11-9-18(10-12-19)22-17-7-3-2-4-8-17/h2-4,6-12,21-22H,5,13-15H2,1H3
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1.90E+4n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 44: 4848-54 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.026
BindingDB Entry DOI: 10.7270/Q23X86QS
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50260418
PNG
(4-Benzenesulfonyl-2-(1-methyl-1,2,5,6-tetrahydropy...)
Show SMILES CN1CCC=C(C1)C1CN(CCO1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C16H22N2O3S/c1-17-9-5-6-14(12-17)16-13-18(10-11-21-16)22(19,20)15-7-3-2-4-8-15/h2-4,6-8,16H,5,9-13H2,1H3
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2.70E+4n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]Quinuclidinyl benzillate from muscarinic M1 receptor in Wistar rat cortex synaptosomal membrane


Bioorg Med Chem 16: 5157-63 (2008)


Article DOI: 10.1016/j.bmc.2008.03.019
BindingDB Entry DOI: 10.7270/Q26973CD
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50300560
PNG
(3-butyl-2-(1-methyl-1,2,5,6-tetrahydropyridin-3-yl...)
Show SMILES CCCCN1C(SCC1=O)C1=CCCN(C)C1
Show InChI InChI=1S/C13H22N2OS/c1-3-4-8-15-12(16)10-17-13(15)11-6-5-7-14(2)9-11/h6,13H,3-5,7-10H2,1-2H3
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3.20E+4n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 44: 4848-54 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.026
BindingDB Entry DOI: 10.7270/Q23X86QS
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50260417
PNG
(4-(2,5-Dichloro-benzenesulfonyl)-2-(1-methyl-1,2,5...)
Show SMILES CN1CCC=C(C1)C1CN(CCO1)S(=O)(=O)c1cc(Cl)ccc1Cl
Show InChI InChI=1S/C16H20Cl2N2O3S/c1-19-6-2-3-12(10-19)15-11-20(7-8-23-15)24(21,22)16-9-13(17)4-5-14(16)18/h3-5,9,15H,2,6-8,10-11H2,1H3
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3.50E+4n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]Quinuclidinyl benzillate from muscarinic M1 receptor in Wistar rat cortex synaptosomal membrane


Bioorg Med Chem 16: 5157-63 (2008)


Article DOI: 10.1016/j.bmc.2008.03.019
BindingDB Entry DOI: 10.7270/Q26973CD
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50300563
PNG
(4-[2-(1-methyl-1,2,5,6-tetrahydropyridin-3-yl)-4-o...)
Show SMILES CN1CCC=C(C1)C1SCC(=O)N1c1ccc(cc1)C(O)=O
Show InChI InChI=1S/C16H18N2O3S/c1-17-8-2-3-12(9-17)15-18(14(19)10-22-15)13-6-4-11(5-7-13)16(20)21/h3-7,15H,2,8-10H2,1H3,(H,20,21)
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3.70E+4n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 44: 4848-54 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.026
BindingDB Entry DOI: 10.7270/Q23X86QS
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50300565
PNG
(2-(1-methyl-1,2,5,6-tetrahydropyridin-3-yl)-3-(4-n...)
Show SMILES CN1CCC=C(C1)C1SCC(=O)N1c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C15H17N3O3S/c1-16-8-2-3-11(9-16)15-17(14(19)10-22-15)12-4-6-13(7-5-12)18(20)21/h3-7,15H,2,8-10H2,1H3
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4.30E+4n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 44: 4848-54 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.026
BindingDB Entry DOI: 10.7270/Q23X86QS
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50260420
PNG
(4-(3-Nitrobenzenesulfonyl)-2-(1-methyl-1,2,5,6-tet...)
Show SMILES CN1CCC=C(C1)C1CN(CCO1)S(=O)(=O)c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C16H21N3O5S/c1-17-7-3-4-13(11-17)16-12-18(8-9-24-16)25(22,23)15-6-2-5-14(10-15)19(20)21/h2,4-6,10,16H,3,7-9,11-12H2,1H3
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6.20E+4n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]Quinuclidinyl benzillate from muscarinic M1 receptor in Wistar rat cortex synaptosomal membrane


Bioorg Med Chem 16: 5157-63 (2008)


Article DOI: 10.1016/j.bmc.2008.03.019
BindingDB Entry DOI: 10.7270/Q26973CD
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50260421
PNG
(4-(4-Nitro-benzenesulfonyl)-2-(1-methyl-1,2,5,6-te...)
Show SMILES CN1CCC=C(C1)C1CN(CCO1)S(=O)(=O)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C16H21N3O5S/c1-17-8-2-3-13(11-17)16-12-18(9-10-24-16)25(22,23)15-6-4-14(5-7-15)19(20)21/h3-7,16H,2,8-12H2,1H3
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6.40E+4n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]Quinuclidinyl benzillate from muscarinic M1 receptor in Wistar rat cortex synaptosomal membrane


Bioorg Med Chem 16: 5157-63 (2008)


Article DOI: 10.1016/j.bmc.2008.03.019
BindingDB Entry DOI: 10.7270/Q26973CD
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM46858
PNG
(1-methyl-3,6-dihydro-2H-pyridine-5-carboxylic acid...)
Show SMILES COC(=O)C1=CCCN(C)C1
Show InChI InChI=1S/C8H13NO2/c1-9-5-3-4-7(6-9)8(10)11-2/h4H,3,5-6H2,1-2H3
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8.60E+4n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 44: 4848-54 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.026
BindingDB Entry DOI: 10.7270/Q23X86QS
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM46858
PNG
(1-methyl-3,6-dihydro-2H-pyridine-5-carboxylic acid...)
Show SMILES COC(=O)C1=CCCN(C)C1
Show InChI InChI=1S/C8H13NO2/c1-9-5-3-4-7(6-9)8(10)11-2/h4H,3,5-6H2,1-2H3
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8.60E+4n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]Quinuclidinyl benzillate from muscarinic M1 receptor in Wistar rat cortex synaptosomal membrane


Bioorg Med Chem 16: 5157-63 (2008)


Article DOI: 10.1016/j.bmc.2008.03.019
BindingDB Entry DOI: 10.7270/Q26973CD
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50260419
PNG
(4-(2-Nitrobenzenesulfonyl)-2-(1-methyl-1,2,5,6-tet...)
Show SMILES CN1CCC=C(C1)C1CN(CCO1)S(=O)(=O)c1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C16H21N3O5S/c1-17-8-4-5-13(11-17)15-12-18(9-10-24-15)25(22,23)16-7-3-2-6-14(16)19(20)21/h2-3,5-7,15H,4,8-12H2,1H3
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9.60E+4n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]Quinuclidinyl benzillate from muscarinic M1 receptor in Wistar rat cortex synaptosomal membrane


Bioorg Med Chem 16: 5157-63 (2008)


Article DOI: 10.1016/j.bmc.2008.03.019
BindingDB Entry DOI: 10.7270/Q26973CD
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50300561
PNG
(3-isopropyl-2-(1-methyl-1,2,5,6-tetrahydropyridin-...)
Show SMILES CC(C)N1C(SCC1=O)C1=CCCN(C)C1
Show InChI InChI=1S/C12H20N2OS/c1-9(2)14-11(15)8-16-12(14)10-5-4-6-13(3)7-10/h5,9,12H,4,6-8H2,1-3H3
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9.70E+4n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 44: 4848-54 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.026
BindingDB Entry DOI: 10.7270/Q23X86QS
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50300567
PNG
(3-(3-hydroxy-phenyl)-2-(1-methyl-1,2,5,6-tetrahydr...)
Show SMILES CN1CCC=C(C1)C1SCC(=O)N1c1cccc(O)c1
Show InChI InChI=1S/C15H18N2O2S/c1-16-7-3-4-11(9-16)15-17(14(19)10-20-15)12-5-2-6-13(18)8-12/h2,4-6,8,15,18H,3,7,9-10H2,1H3
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1.02E+5n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 44: 4848-54 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.026
BindingDB Entry DOI: 10.7270/Q23X86QS
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50300558
PNG
(2-(1-methyl-1,2,5,6-tetrahydropyridin-3-yl)-3-phen...)
Show SMILES CN1CCC=C(C1)C1SCC(=O)N1c1ccccc1
Show InChI InChI=1S/C15H18N2OS/c1-16-9-5-6-12(10-16)15-17(14(18)11-19-15)13-7-3-2-4-8-13/h2-4,6-8,15H,5,9-11H2,1H3
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1.05E+5n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 44: 4848-54 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.026
BindingDB Entry DOI: 10.7270/Q23X86QS
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50300559
PNG
(3-hexyl-2-(1-methyl-1,2,5,6-tetrahydropyridin-3-yl...)
Show SMILES CCCCCCN1C(SCC1=O)C1=CCCN(C)C1
Show InChI InChI=1S/C15H26N2OS/c1-3-4-5-6-10-17-14(18)12-19-15(17)13-8-7-9-16(2)11-13/h8,15H,3-7,9-12H2,1-2H3
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1.10E+5n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 44: 4848-54 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.026
BindingDB Entry DOI: 10.7270/Q23X86QS
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50300562
PNG
(3-(4-bromophenyl)-2-(1-methyl-1,2,5,6-tetrahydropy...)
Show SMILES CN1CCC=C(C1)C1SCC(=O)N1c1ccc(Br)cc1
Show InChI InChI=1S/C15H17BrN2OS/c1-17-8-2-3-11(9-17)15-18(14(19)10-20-15)13-6-4-12(16)5-7-13/h3-7,15H,2,8-10H2,1H3
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1.22E+5n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 44: 4848-54 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.026
BindingDB Entry DOI: 10.7270/Q23X86QS
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50300566
PNG
(3-(4-methyl-2-nitro-phenyl)-2-(1-methyl-1,2,5,6-te...)
Show SMILES CN1CCC=C(C1)C1SCC(=O)N1c1ccc(C)cc1[N+]([O-])=O
Show InChI InChI=1S/C16H19N3O3S/c1-11-5-6-13(14(8-11)19(21)22)18-15(20)10-23-16(18)12-4-3-7-17(2)9-12/h4-6,8,16H,3,7,9-10H2,1-2H3
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1.25E+5n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 44: 4848-54 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.026
BindingDB Entry DOI: 10.7270/Q23X86QS
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50300556
PNG
(3-benzyl-2-(1-methyl-1,2,5,6-tetrahydropyridin-3-y...)
Show SMILES CN1CCC=C(C1)C1SCC(=O)N1Cc1ccccc1
Show InChI InChI=1S/C16H20N2OS/c1-17-9-5-8-14(11-17)16-18(15(19)12-20-16)10-13-6-3-2-4-7-13/h2-4,6-8,16H,5,9-12H2,1H3
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1.49E+5n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 44: 4848-54 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.026
BindingDB Entry DOI: 10.7270/Q23X86QS
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50300555
PNG
(3-(4-chlorophenyl)-2-(1,2,5,6-tetrahydro-1-methylp...)
Show SMILES CN1CCC=C(C1)C1SCC(=O)N1c1ccc(Cl)cc1
Show InChI InChI=1S/C15H17ClN2OS/c1-17-8-2-3-11(9-17)15-18(14(19)10-20-15)13-6-4-12(16)5-7-13/h3-7,15H,2,8-10H2,1H3
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2.00E+5n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 44: 4848-54 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.026
BindingDB Entry DOI: 10.7270/Q23X86QS
More data for this
Ligand-Target Pair
Muscarinic acetylcholine receptor M1


(RAT)
BDBM50300557
PNG
(3-ethyl-2-(1-methyl-1,2,5,6-tetrahydropyridin-3-yl...)
Show SMILES CCN1C(SCC1=O)C1=CCCN(C)C1
Show InChI InChI=1S/C11H18N2OS/c1-3-13-10(14)8-15-11(13)9-5-4-6-12(2)7-9/h5,11H,3-4,6-8H2,1-2H3
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2.30E+5n/an/an/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Displacement of [3H]QNB from muscarinic M1 receptor in Wistar rat brain cortex membrane after 2 hrs by liquid scintillation counting


Eur J Med Chem 44: 4848-54 (2009)


Article DOI: 10.1016/j.ejmech.2009.07.026
BindingDB Entry DOI: 10.7270/Q23X86QS
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50049128
PNG
(5-(1-Hydroxy-ethyl)-2-propyl-3-[2'-(2H-tetrazol-5-...)
Show SMILES CCCc1nc(C(C)O)c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C23H24N6O3/c1-3-6-19-24-20(14(2)30)21(23(31)32)29(19)13-15-9-11-16(12-10-15)17-7-4-5-8-18(17)22-25-27-28-26-22/h4-5,7-12,14,30H,3,6,13H2,1-2H3,(H,31,32)(H,25,26,27,28)
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n/an/a 4.90n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50049118
PNG
(2-Ethyl-5-(1-hydroxy-1-methyl-ethyl)-3-[2'-(2H-tet...)
Show SMILES CCc1nc(c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C(C)(C)O
Show InChI InChI=1S/C23H24N6O3/c1-4-18-24-20(23(2,3)32)19(22(30)31)29(18)13-14-9-11-15(12-10-14)16-7-5-6-8-17(16)21-25-27-28-26-21/h5-12,32H,4,13H2,1-3H3,(H,30,31)(H,25,26,27,28)
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n/an/a 5.30n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50049123
PNG
(5-Hydroxymethyl-2-propyl-3-[2'-(2H-tetrazol-5-yl)-...)
Show SMILES CCCc1nc(CO)c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C22H22N6O3/c1-2-5-19-23-18(13-29)20(22(30)31)28(19)12-14-8-10-15(11-9-14)16-6-3-4-7-17(16)21-24-26-27-25-21/h3-4,6-11,29H,2,5,12-13H2,1H3,(H,30,31)(H,24,25,26,27)
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n/an/a 6.90n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50241364
PNG
(4-(1-hydroxy-1-methylethyl)-2-propyl-1-{[2'-(1H-te...)
Show SMILES CCCc1nc(c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C(C)(C)O
Show InChI InChI=1S/C24H26N6O3/c1-4-7-19-25-21(24(2,3)33)20(23(31)32)30(19)14-15-10-12-16(13-11-15)17-8-5-6-9-18(17)22-26-28-29-27-22/h5-6,8-13,33H,4,7,14H2,1-3H3,(H,31,32)(H,26,27,28,29)
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n/an/a 8.10n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50049107
PNG
(2-Propyl-3-[2'-(2H-tetrazol-5-yl)-biphenyl-4-ylmet...)
Show SMILES CCCc1ncc(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C21H20N6O2/c1-2-5-19-22-12-18(21(28)29)27(19)13-14-8-10-15(11-9-14)16-6-3-4-7-17(16)20-23-25-26-24-20/h3-4,6-12H,2,5,13H2,1H3,(H,28,29)(H,23,24,25,26)
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n/an/a 9.10n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50049109
PNG
(2-Butyl-5-(1-hydroxy-1-methyl-ethyl)-3-[2'-(2H-tet...)
Show SMILES CCCCc1nc(c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1)C(C)(C)O
Show InChI InChI=1S/C25H28N6O3/c1-4-5-10-20-26-22(25(2,3)34)21(24(32)33)31(20)15-16-11-13-17(14-12-16)18-8-6-7-9-19(18)23-27-29-30-28-23/h6-9,11-14,34H,4-5,10,15H2,1-3H3,(H,32,33)(H,27,28,29,30)
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n/an/a 9.5n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50049124
PNG
(5-Methyl-2-propyl-3-[2'-(1H-tetrazol-5-yl)-bipheny...)
Show SMILES CCCc1nc(C)c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C22H22N6O2/c1-3-6-19-23-14(2)20(22(29)30)28(19)13-15-9-11-16(12-10-15)17-7-4-5-8-18(17)21-24-26-27-25-21/h4-5,7-12H,3,6,13H2,1-2H3,(H,29,30)(H,24,25,26,27)
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n/an/a 11n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50049116
PNG
(5-Ethyl-2-propyl-3-(2'-tetrazol-1-yl-biphenyl-4-yl...)
Show SMILES CCCc1nc(CC)c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C23H24N6O2/c1-3-7-20-24-19(4-2)21(23(30)31)29(20)14-15-10-12-16(13-11-15)17-8-5-6-9-18(17)22-25-27-28-26-22/h5-6,8-13H,3-4,7,14H2,1-2H3,(H,30,31)(H,25,26,27,28)
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n/an/a 12n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50188016
PNG
(1-[bis(4-fluoro-phenyl)-methyl]-4-(2-pyrrolidin-1-...)
Show SMILES Fc1ccc(cc1)C(N1CCN(CCN2CCCC2)CC1)c1ccc(F)cc1
Show InChI InChI=1S/C23H29F2N3/c24-21-7-3-19(4-8-21)23(20-5-9-22(25)10-6-20)28-17-15-27(16-18-28)14-13-26-11-1-2-12-26/h3-10,23H,1-2,11-18H2
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n/an/a 17.6n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of electric eel AchE


Bioorg Med Chem Lett 16: 3932-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.030
BindingDB Entry DOI: 10.7270/Q2RJ4J3F
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50188016
PNG
(1-[bis(4-fluoro-phenyl)-methyl]-4-(2-pyrrolidin-1-...)
Show SMILES Fc1ccc(cc1)C(N1CCN(CCN2CCCC2)CC1)c1ccc(F)cc1
Show InChI InChI=1S/C23H29F2N3/c24-21-7-3-19(4-8-21)23(20-5-9-22(25)10-6-20)28-17-15-27(16-18-28)14-13-26-11-1-2-12-26/h3-10,23H,1-2,11-18H2
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n/an/a 18.8n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat brain homogenate AchE


Bioorg Med Chem Lett 16: 3932-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.030
BindingDB Entry DOI: 10.7270/Q2RJ4J3F
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50188016
PNG
(1-[bis(4-fluoro-phenyl)-methyl]-4-(2-pyrrolidin-1-...)
Show SMILES Fc1ccc(cc1)C(N1CCN(CCN2CCCC2)CC1)c1ccc(F)cc1
Show InChI InChI=1S/C23H29F2N3/c24-21-7-3-19(4-8-21)23(20-5-9-22(25)10-6-20)28-17-15-27(16-18-28)14-13-26-11-1-2-12-26/h3-10,23H,1-2,11-18H2
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n/an/a 21n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of human serum AchE


Bioorg Med Chem Lett 16: 3932-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.030
BindingDB Entry DOI: 10.7270/Q2RJ4J3F
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50006909
PNG
(2-Butyl-5-chloro-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nc(Cl)c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C22H21ClN6O2/c1-2-3-8-18-24-20(23)19(22(30)31)29(18)13-14-9-11-15(12-10-14)16-6-4-5-7-17(16)21-25-27-28-26-21/h4-7,9-12H,2-3,8,13H2,1H3,(H,30,31)(H,25,26,27,28)
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n/an/a 22n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50006909
PNG
(2-Butyl-5-chloro-3-[2'-(1H-tetrazol-5-yl)-biphenyl...)
Show SMILES CCCCc1nc(Cl)c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C22H21ClN6O2/c1-2-3-8-18-24-20(23)19(22(30)31)29(18)13-14-9-11-15(12-10-14)16-6-4-5-7-17(16)21-25-27-28-26-21/h4-7,9-12H,2-3,8,13H2,1H3,(H,30,31)(H,25,26,27,28)
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n/an/a 22n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of [125l]-All binding to bovine adrenal cortex


Bioorg Med Chem Lett 4: 177-182 (1994)


Article DOI: 10.1016/S0960-894X(01)81143-4
BindingDB Entry DOI: 10.7270/Q2BG2NZQ
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50049112
PNG
(3-(2'-Carboxy-biphenyl-4-ylmethyl)-5-(1-hydroxy-et...)
Show SMILES CCCc1nc(C(C)O)c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1C(O)=O
Show InChI InChI=1S/C23H24N2O5/c1-3-6-19-24-20(14(2)26)21(23(29)30)25(19)13-15-9-11-16(12-10-15)17-7-4-5-8-18(17)22(27)28/h4-5,7-12,14,26H,3,6,13H2,1-2H3,(H,27,28)(H,29,30)
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n/an/a 28n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50049132
PNG
(3-(2'-Carboxy-biphenyl-4-ylmethyl)-5-(1-hydroxy-1-...)
Show SMILES CCCc1nc(c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(C)(C)O
Show InChI InChI=1S/C24H26N2O5/c1-4-7-19-25-21(24(2,3)31)20(23(29)30)26(19)14-15-10-12-16(13-11-15)17-8-5-6-9-18(17)22(27)28/h5-6,8-13,31H,4,7,14H2,1-3H3,(H,27,28)(H,29,30)
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n/an/a 28n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50049122
PNG
(2-Butyl-3-(2'-carboxy-biphenyl-4-ylmethyl)-5-(1-hy...)
Show SMILES CCCCc1nc(c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(C)(C)O
Show InChI InChI=1S/C25H28N2O5/c1-4-5-10-20-26-22(25(2,3)32)21(24(30)31)27(20)15-16-11-13-17(14-12-16)18-8-6-7-9-19(18)23(28)29/h6-9,11-14,32H,4-5,10,15H2,1-3H3,(H,28,29)(H,30,31)
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n/an/a 30n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50022775
PNG
((m-Hydroxyphenyl)trimethylammonium dimethylcarbama...)
Show SMILES CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1
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n/an/a 35n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat brain AChE by Ellman colorimetric assay


Bioorg Med Chem 15: 7391-8 (2007)


Article DOI: 10.1016/j.bmc.2007.07.014
BindingDB Entry DOI: 10.7270/Q2FB53R3
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50049117
PNG
(3-(2'-Carboxy-biphenyl-4-ylmethyl)-2-ethyl-5-(1-hy...)
Show SMILES CCc1nc(c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1C(O)=O)C(C)(C)O
Show InChI InChI=1S/C23H24N2O5/c1-4-18-24-20(23(2,3)30)19(22(28)29)25(18)13-14-9-11-15(12-10-14)16-7-5-6-8-17(16)21(26)27/h5-12,30H,4,13H2,1-3H3,(H,26,27)(H,28,29)
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n/an/a 37n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50188013
PNG
(1-[bis(4-fluoro-phenyl)-methyl]-4-1(benzyl)-4-(2-c...)
Show SMILES Fc1ccc(cc1)C(N1CCN(Cc2ccc(cc2)-c2ccccc2C#N)CC1)c1ccc(F)cc1
Show InChI InChI=1S/C31H27F2N3/c32-28-13-9-25(10-14-28)31(26-11-15-29(33)16-12-26)36-19-17-35(18-20-36)22-23-5-7-24(8-6-23)30-4-2-1-3-27(30)21-34/h1-16,31H,17-20,22H2
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n/an/a 37.5n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat brain homogenate AchE


Bioorg Med Chem Lett 16: 3932-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.030
BindingDB Entry DOI: 10.7270/Q2RJ4J3F
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50022775
PNG
((m-Hydroxyphenyl)trimethylammonium dimethylcarbama...)
Show SMILES CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1
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n/an/a 37.5n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of rat brain homogenate AchE


Bioorg Med Chem Lett 16: 3932-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.030
BindingDB Entry DOI: 10.7270/Q2RJ4J3F
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50022775
PNG
((m-Hydroxyphenyl)trimethylammonium dimethylcarbama...)
Show SMILES CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1
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n/an/a 40n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of Wistar rat brain homogenate AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50022775
PNG
((m-Hydroxyphenyl)trimethylammonium dimethylcarbama...)
Show SMILES CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1
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n/an/a 41n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of human serum AChE by Ellman's assay


Eur J Med Chem 44: 4057-62 (2009)


Article DOI: 10.1016/j.ejmech.2009.04.042
BindingDB Entry DOI: 10.7270/Q2MK6CZF
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50022775
PNG
((m-Hydroxyphenyl)trimethylammonium dimethylcarbama...)
Show SMILES CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1
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n/an/a 42.1n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of human serum AchE


Bioorg Med Chem Lett 16: 3932-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.05.030
BindingDB Entry DOI: 10.7270/Q2RJ4J3F
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Homo sapiens (Human))
BDBM50022775
PNG
((m-Hydroxyphenyl)trimethylammonium dimethylcarbama...)
Show SMILES CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1
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n/an/a 45n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of human serum AChE by Ellman colorimetric assay


Bioorg Med Chem 15: 7391-8 (2007)


Article DOI: 10.1016/j.bmc.2007.07.014
BindingDB Entry DOI: 10.7270/Q2FB53R3
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50049130
PNG
(5-Isopropyl-2-propyl-3-[2'-(1H-tetrazol-5-yl)-biph...)
Show SMILES CCCc1nc(C(C)C)c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C24H26N6O2/c1-4-7-20-25-21(15(2)3)22(24(31)32)30(20)14-16-10-12-17(13-11-16)18-8-5-6-9-19(18)23-26-28-29-27-23/h5-6,8-13,15H,4,7,14H2,1-3H3,(H,31,32)(H,26,27,28,29)
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n/an/a 46n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Electrophorus electricus (Electric eel))
BDBM50022775
PNG
((m-Hydroxyphenyl)trimethylammonium dimethylcarbama...)
Show SMILES CN(C)C(=O)Oc1cccc(c1)[N+](C)(C)C
Show InChI InChI=1S/C12H19N2O2/c1-13(2)12(15)16-11-8-6-7-10(9-11)14(3,4)5/h6-9H,1-5H3/q+1
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n/an/a 47.5n/an/an/an/an/an/a



University of Mysore

Curated by ChEMBL


Assay Description
Inhibition of electric eel AChE by Ellman colorimetric assay


Bioorg Med Chem 15: 7391-8 (2007)


Article DOI: 10.1016/j.bmc.2007.07.014
BindingDB Entry DOI: 10.7270/Q2FB53R3
More data for this
Ligand-Target Pair
Angiotensin II type 1a (AT-1a) receptor


(Bos taurus)
BDBM50049113
PNG
(5-Isopropenyl-2-propyl-3-[2'-(2H-tetrazol-5-yl)-bi...)
Show SMILES CCCc1nc(C(C)=C)c(C(O)=O)n1Cc1ccc(cc1)-c1ccccc1-c1nnn[nH]1
Show InChI InChI=1S/C24H24N6O2/c1-4-7-20-25-21(15(2)3)22(24(31)32)30(20)14-16-10-12-17(13-11-16)18-8-5-6-9-19(18)23-26-28-29-27-23/h5-6,8-13H,2,4,7,14H2,1,3H3,(H,31,32)(H,26,27,28,29)
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n/an/a 50n/an/an/an/an/an/a



Sankyo Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro for inhibition of [125I]-angiotensin II (0.1 nM) binding to angiotensin II receptor type 1 in membrane fractions of bovine adrenal cortex


J Med Chem 39: 323-38 (1996)


Article DOI: 10.1021/jm950450f
BindingDB Entry DOI: 10.7270/Q28S4P18
More data for this
Ligand-Target Pair
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