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PubMed code 1347318

Compile data set for download or QSAR
Found 52 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001912
PNG
(4-Methanesulfonylamino-N-(4-phenyl-piperazin-2-ylm...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C(=O)NCC1CN(CCN1)c1ccccc1
Show InChI InChI=1S/C19H24N4O3S/c1-27(25,26)22-16-9-7-15(8-10-16)19(24)21-13-17-14-23(12-11-20-17)18-5-3-2-4-6-18/h2-10,17,20,22H,11-14H2,1H3,(H,21,24)
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n/an/a 160n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001906
PNG
(4-Methanesulfonylamino-N-[4-(2-methoxy-phenyl)-pip...)
Show SMILES COc1ccccc1N1CCNC(CNC(=O)c2ccc(NS(C)(=O)=O)cc2)C1
Show InChI InChI=1S/C20H26N4O4S/c1-28-19-6-4-3-5-18(19)24-12-11-21-17(14-24)13-22-20(25)15-7-9-16(10-8-15)23-29(2,26)27/h3-10,17,21,23H,11-14H2,1-2H3,(H,22,25)
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n/an/a 230n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001907
PNG
(4-Imidazol-1-yl-N-(4-phenyl-piperazin-2-ylmethyl)-...)
Show SMILES O=C(NCC1CN(CCN1)c1ccccc1)c1ccc(cc1)-n1ccnc1
Show InChI InChI=1S/C21H23N5O/c27-21(17-6-8-20(9-7-17)26-12-10-22-16-26)24-14-18-15-25(13-11-23-18)19-4-2-1-3-5-19/h1-10,12,16,18,23H,11,13-15H2,(H,24,27)
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Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001906
PNG
(4-Methanesulfonylamino-N-[4-(2-methoxy-phenyl)-pip...)
Show SMILES COc1ccccc1N1CCNC(CNC(=O)c2ccc(NS(C)(=O)=O)cc2)C1
Show InChI InChI=1S/C20H26N4O4S/c1-28-19-6-4-3-5-18(19)24-12-11-21-17(14-24)13-22-20(25)15-7-9-16(10-8-15)23-29(2,26)27/h3-10,17,21,23H,11-14H2,1-2H3,(H,22,25)
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n/an/a 630n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001896
PNG
(CHEMBL165901 | N-(4-Phenyl-piperazin-2-ylmethyl)-b...)
Show SMILES O=C(NCC1CN(CCN1)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C18H21N3O/c22-18(15-7-3-1-4-8-15)20-13-16-14-21(12-11-19-16)17-9-5-2-6-10-17/h1-10,16,19H,11-14H2,(H,20,22)
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n/an/a 680n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001900
PNG
(CHEMBL162182 | N-{4-[(4-Phenyl-piperazin-2-ylmethy...)
Show SMILES CS(=O)(=O)Nc1ccc(NCC2CN(CCN2)c2ccccc2)cc1
Show InChI InChI=1S/C18H24N4O2S/c1-25(23,24)21-16-9-7-15(8-10-16)20-13-17-14-22(12-11-19-17)18-5-3-2-4-6-18/h2-10,17,19-21H,11-14H2,1H3
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n/an/a 1.00E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001914
PNG
(CHEMBL350432 | N-[4-(3-Chloro-phenyl)-piperazin-2-...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C(=O)NCC1CN(CCN1)c1cccc(Cl)c1
Show InChI InChI=1S/C19H23ClN4O3S/c1-28(26,27)23-16-7-5-14(6-8-16)19(25)22-12-17-13-24(10-9-21-17)18-4-2-3-15(20)11-18/h2-8,11,17,21,23H,9-10,12-13H2,1H3,(H,22,25)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001910
PNG
(4-(Methanesulfonyl-methyl-amino)-N-(4-phenyl-piper...)
Show SMILES CN(c1ccc(cc1)C(=O)NCC1CN(CCN1)c1ccccc1)S(C)(=O)=O
Show InChI InChI=1S/C20H26N4O3S/c1-23(28(2,26)27)18-10-8-16(9-11-18)20(25)22-14-17-15-24(13-12-21-17)19-6-4-3-5-7-19/h3-11,17,21H,12-15H2,1-2H3,(H,22,25)
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n/an/a 1.10E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001905
PNG
(4-Methanesulfonylamino-N-[4-(3-methoxy-phenyl)-pip...)
Show SMILES COc1cccc(c1)N1CCNC(CNC(=O)c2ccc(NS(C)(=O)=O)cc2)C1
Show InChI InChI=1S/C20H26N4O4S/c1-28-19-5-3-4-18(12-19)24-11-10-21-17(14-24)13-22-20(25)15-6-8-16(9-7-15)23-29(2,26)27/h3-9,12,17,21,23H,10-11,13-14H2,1-2H3,(H,22,25)
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n/an/a 1.70E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001862
PNG
((N-(o-methoxyphenyl)piperazine)1-(2-Methoxy-phenyl...)
Show SMILES COc1ccccc1N1CCNCC1
Show InChI InChI=1S/C11H16N2O/c1-14-11-5-3-2-4-10(11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
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n/an/a 2.00E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001915
PNG
(1-(3-chlorophenyl)piperazine | CHEMBL478 | m-Chlor...)
Show SMILES Clc1cccc(c1)N1CCNCC1
Show InChI InChI=1S/C10H13ClN2/c11-9-2-1-3-10(8-9)13-6-4-12-5-7-13/h1-3,8,12H,4-7H2
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n/an/a 2.00E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001900
PNG
(CHEMBL162182 | N-{4-[(4-Phenyl-piperazin-2-ylmethy...)
Show SMILES CS(=O)(=O)Nc1ccc(NCC2CN(CCN2)c2ccccc2)cc1
Show InChI InChI=1S/C18H24N4O2S/c1-25(23,24)21-16-9-7-15(8-10-16)20-13-17-14-22(12-11-19-17)18-5-3-2-4-6-18/h2-10,17,19-21H,11-14H2,1H3
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n/an/a 2.30E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001909
PNG
(CHEMBL163153 | N-(4-{[(4-Phenyl-piperazin-2-ylmeth...)
Show SMILES CS(=O)(=O)Nc1ccc(CNCC2CN(CCN2)c2ccccc2)cc1
Show InChI InChI=1S/C19H26N4O2S/c1-26(24,25)22-17-9-7-16(8-10-17)13-20-14-18-15-23(12-11-21-18)19-5-3-2-4-6-19/h2-10,18,20-22H,11-15H2,1H3
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n/an/a 3.00E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001895
PNG
(CHEMBL350581 | N-[4-(4-Phenyl-piperazin-2-ylmethox...)
Show SMILES CS(=O)(=O)Nc1ccc(OCC2CN(CCN2)c2ccccc2)cc1
Show InChI InChI=1S/C18H23N3O3S/c1-25(22,23)20-15-7-9-18(10-8-15)24-14-16-13-21(12-11-19-16)17-5-3-2-4-6-17/h2-10,16,19-20H,11-14H2,1H3
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n/an/a 3.30E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001912
PNG
(4-Methanesulfonylamino-N-(4-phenyl-piperazin-2-ylm...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C(=O)NCC1CN(CCN1)c1ccccc1
Show InChI InChI=1S/C19H24N4O3S/c1-27(25,26)22-16-9-7-15(8-10-16)19(24)21-13-17-14-23(12-11-20-17)18-5-3-2-4-6-18/h2-10,17,20,22H,11-14H2,1H3,(H,21,24)
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n/an/a 3.40E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001905
PNG
(4-Methanesulfonylamino-N-[4-(3-methoxy-phenyl)-pip...)
Show SMILES COc1cccc(c1)N1CCNC(CNC(=O)c2ccc(NS(C)(=O)=O)cc2)C1
Show InChI InChI=1S/C20H26N4O4S/c1-28-19-5-3-4-18(12-19)24-11-10-21-17(14-24)13-22-20(25)15-6-8-16(9-7-15)23-29(2,26)27/h3-9,12,17,21,23H,10-11,13-14H2,1-2H3,(H,22,25)
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n/an/a 3.50E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001914
PNG
(CHEMBL350432 | N-[4-(3-Chloro-phenyl)-piperazin-2-...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C(=O)NCC1CN(CCN1)c1cccc(Cl)c1
Show InChI InChI=1S/C19H23ClN4O3S/c1-28(26,27)23-16-7-5-14(6-8-16)19(25)22-12-17-13-24(10-9-21-17)18-4-2-3-15(20)11-18/h2-8,11,17,21,23H,9-10,12-13H2,1H3,(H,22,25)
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n/an/a 3.80E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001910
PNG
(4-(Methanesulfonyl-methyl-amino)-N-(4-phenyl-piper...)
Show SMILES CN(c1ccc(cc1)C(=O)NCC1CN(CCN1)c1ccccc1)S(C)(=O)=O
Show InChI InChI=1S/C20H26N4O3S/c1-23(28(2,26)27)18-10-8-16(9-11-18)20(25)22-14-17-15-24(13-12-21-17)19-6-4-3-5-7-19/h3-11,17,21H,12-15H2,1-2H3,(H,22,25)
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n/an/a 4.30E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001907
PNG
(4-Imidazol-1-yl-N-(4-phenyl-piperazin-2-ylmethyl)-...)
Show SMILES O=C(NCC1CN(CCN1)c1ccccc1)c1ccc(cc1)-n1ccnc1
Show InChI InChI=1S/C21H23N5O/c27-21(17-6-8-20(9-7-17)26-12-10-22-16-26)24-14-18-15-25(13-11-23-18)19-4-2-1-3-5-19/h1-10,12,16,18,23H,11,13-15H2,(H,24,27)
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n/an/a 4.30E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001895
PNG
(CHEMBL350581 | N-[4-(4-Phenyl-piperazin-2-ylmethox...)
Show SMILES CS(=O)(=O)Nc1ccc(OCC2CN(CCN2)c2ccccc2)cc1
Show InChI InChI=1S/C18H23N3O3S/c1-25(22,23)20-15-7-9-18(10-8-15)24-14-16-13-21(12-11-19-16)17-5-3-2-4-6-17/h2-10,16,19-20H,11-14H2,1H3
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n/an/a 4.50E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001909
PNG
(CHEMBL163153 | N-(4-{[(4-Phenyl-piperazin-2-ylmeth...)
Show SMILES CS(=O)(=O)Nc1ccc(CNCC2CN(CCN2)c2ccccc2)cc1
Show InChI InChI=1S/C19H26N4O2S/c1-26(24,25)22-17-9-7-16(8-10-17)13-20-14-18-15-23(12-11-21-18)19-5-3-2-4-6-19/h2-10,18,20-22H,11-15H2,1H3
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n/an/a 4.60E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM25762
PNG
(CHEMBL471 | N-{4-[1-hydroxy-2-(propan-2-ylamino)et...)
Show SMILES CC(C)NCC(O)c1ccc(NS(C)(=O)=O)cc1
Show InChI InChI=1S/C12H20N2O3S/c1-9(2)13-8-12(15)10-4-6-11(7-5-10)14-18(3,16)17/h4-7,9,12-15H,8H2,1-3H3
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n/an/a 5.00E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001896
PNG
(CHEMBL165901 | N-(4-Phenyl-piperazin-2-ylmethyl)-b...)
Show SMILES O=C(NCC1CN(CCN1)c1ccccc1)c1ccccc1
Show InChI InChI=1S/C18H21N3O/c22-18(15-7-3-1-4-8-15)20-13-16-14-21(12-11-19-16)17-9-5-2-6-10-17/h1-10,16,19H,11-14H2,(H,20,22)
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n/an/a 6.20E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001917
PNG
(1-(3-Methoxy-phenyl)-piperazine | CHEMBL59597)
Show SMILES COc1cccc(c1)N1CCNCC1
Show InChI InChI=1S/C11H16N2O/c1-14-11-4-2-3-10(9-11)13-7-5-12-6-8-13/h2-4,9,12H,5-8H2,1H3
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n/an/a 8.00E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM25762
PNG
(CHEMBL471 | N-{4-[1-hydroxy-2-(propan-2-ylamino)et...)
Show SMILES CC(C)NCC(O)c1ccc(NS(C)(=O)=O)cc1
Show InChI InChI=1S/C12H20N2O3S/c1-9(2)13-8-12(15)10-4-6-11(7-5-10)14-18(3,16)17/h4-7,9,12-15H,8H2,1-3H3
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n/an/a 9.00E+3n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001904
PNG
(1-m-Tolyl-piperazine | CHEMBL165175)
Show SMILES Cc1cccc(c1)N1CCNCC1
Show InChI InChI=1S/C11H16N2/c1-10-3-2-4-11(9-10)13-7-5-12-6-8-13/h2-4,9,12H,5-8H2,1H3
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n/an/a 1.20E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001901
PNG
(1-(2-Chloro-phenyl)-piperazine | CHEMBL9841)
Show SMILES Clc1ccccc1N1CCNCC1
Show InChI InChI=1S/C10H13ClN2/c11-9-3-1-2-4-10(9)13-7-5-12-6-8-13/h1-4,12H,5-8H2
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n/an/a 1.20E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001908
PNG
(1-(4-Nitro-phenyl)-piperazine | CHEMBL165012)
Show SMILES [O-][N+](=O)c1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C10H13N3O2/c14-13(15)10-3-1-9(2-4-10)12-7-5-11-6-8-12/h1-4,11H,5-8H2
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n/an/a 1.30E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001903
PNG
(1-o-Tolyl-piperazine | CHEMBL9746)
Show SMILES Cc1ccccc1N1CCNCC1
Show InChI InChI=1S/C11H16N2/c1-10-4-2-3-5-11(10)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
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n/an/a 1.40E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001897
PNG
(1-(4-Chloro-phenyl)-piperazine | CHEMBL114478 | pC...)
Show SMILES Clc1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C10H13ClN2/c11-9-1-3-10(4-2-9)13-7-5-12-6-8-13/h1-4,12H,5-8H2
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n/an/a 1.50E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001901
PNG
(1-(2-Chloro-phenyl)-piperazine | CHEMBL9841)
Show SMILES Clc1ccccc1N1CCNCC1
Show InChI InChI=1S/C10H13ClN2/c11-9-3-1-2-4-10(9)13-7-5-12-6-8-13/h1-4,12H,5-8H2
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n/an/a 1.60E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001915
PNG
(1-(3-chlorophenyl)piperazine | CHEMBL478 | m-Chlor...)
Show SMILES Clc1cccc(c1)N1CCNCC1
Show InChI InChI=1S/C10H13ClN2/c11-9-2-1-3-10(8-9)13-6-4-12-5-7-13/h1-3,8,12H,4-7H2
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n/an/a 1.80E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001898
PNG
(1-Phenyl-piperazine | CHEMBL9434 | PHENYLPIPERAZIN...)
Show SMILES C1CN(CCN1)c1ccccc1
Show InChI InChI=1S/C10H14N2/c1-2-4-10(5-3-1)12-8-6-11-7-9-12/h1-5,11H,6-9H2
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n/an/a 1.90E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001894
PNG
(CHEMBL351183 | N-{4-[(1-Phenyl-piperazin-2-ylmethy...)
Show SMILES CS(=O)(=O)Nc1ccc(NCC2CNCCN2c2ccccc2)cc1
Show InChI InChI=1S/C18H24N4O2S/c1-25(23,24)21-16-9-7-15(8-10-16)20-14-18-13-19-11-12-22(18)17-5-3-2-4-6-17/h2-10,18-21H,11-14H2,1H3
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n/an/a 2.60E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001903
PNG
(1-o-Tolyl-piperazine | CHEMBL9746)
Show SMILES Cc1ccccc1N1CCNCC1
Show InChI InChI=1S/C11H16N2/c1-10-4-2-3-5-11(10)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
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n/an/a 2.90E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001917
PNG
(1-(3-Methoxy-phenyl)-piperazine | CHEMBL59597)
Show SMILES COc1cccc(c1)N1CCNCC1
Show InChI InChI=1S/C11H16N2O/c1-14-11-4-2-3-10(9-11)13-7-5-12-6-8-13/h2-4,9,12H,5-8H2,1H3
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n/an/a 2.90E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001902
PNG
(4-Methanesulfonylamino-N-(1-phenyl-piperazin-2-ylm...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C(=O)NCC1CNCCN1c1ccccc1
Show InChI InChI=1S/C19H24N4O3S/c1-27(25,26)22-16-9-7-15(8-10-16)19(24)21-14-18-13-20-11-12-23(18)17-5-3-2-4-6-17/h2-10,18,20,22H,11-14H2,1H3,(H,21,24)
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n/an/a 3.10E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001902
PNG
(4-Methanesulfonylamino-N-(1-phenyl-piperazin-2-ylm...)
Show SMILES CS(=O)(=O)Nc1ccc(cc1)C(=O)NCC1CNCCN1c1ccccc1
Show InChI InChI=1S/C19H24N4O3S/c1-27(25,26)22-16-9-7-15(8-10-16)19(24)21-14-18-13-20-11-12-23(18)17-5-3-2-4-6-17/h2-10,18,20,22H,11-14H2,1H3,(H,21,24)
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n/an/a 3.10E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001862
PNG
((N-(o-methoxyphenyl)piperazine)1-(2-Methoxy-phenyl...)
Show SMILES COc1ccccc1N1CCNCC1
Show InChI InChI=1S/C11H16N2O/c1-14-11-5-3-2-4-10(11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
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n/an/a 3.40E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001913
PNG
(1-(4-Methoxy-phenyl)-piperazine | 4-METHOXYPHENYLP...)
Show SMILES COc1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C11H16N2O/c1-14-11-4-2-10(3-5-11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
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n/an/a 3.80E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001911
PNG
(1-p-Tolyl-piperazine | CHEMBL165462)
Show SMILES Cc1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C11H16N2/c1-10-2-4-11(5-3-10)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
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n/an/a 3.80E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001904
PNG
(1-m-Tolyl-piperazine | CHEMBL165175)
Show SMILES Cc1cccc(c1)N1CCNCC1
Show InChI InChI=1S/C11H16N2/c1-10-3-2-4-11(9-10)13-7-5-12-6-8-13/h2-4,9,12H,5-8H2,1H3
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n/an/a 4.00E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001894
PNG
(CHEMBL351183 | N-{4-[(1-Phenyl-piperazin-2-ylmethy...)
Show SMILES CS(=O)(=O)Nc1ccc(NCC2CNCCN2c2ccccc2)cc1
Show InChI InChI=1S/C18H24N4O2S/c1-25(23,24)21-16-9-7-15(8-10-16)20-14-18-13-19-11-12-22(18)17-5-3-2-4-6-17/h2-10,18-21H,11-14H2,1H3
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n/an/a 4.20E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001908
PNG
(1-(4-Nitro-phenyl)-piperazine | CHEMBL165012)
Show SMILES [O-][N+](=O)c1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C10H13N3O2/c14-13(15)10-3-1-9(2-4-10)12-7-5-11-6-8-12/h1-4,11H,5-8H2
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n/an/a 5.60E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001897
PNG
(1-(4-Chloro-phenyl)-piperazine | CHEMBL114478 | pC...)
Show SMILES Clc1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C10H13ClN2/c11-9-1-3-10(4-2-9)13-7-5-12-6-8-13/h1-4,12H,5-8H2
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n/an/a 7.00E+4n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001913
PNG
(1-(4-Methoxy-phenyl)-piperazine | 4-METHOXYPHENYLP...)
Show SMILES COc1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C11H16N2O/c1-14-11-4-2-10(3-5-11)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
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n/an/a>1.00E+5n/an/an/an/an/an/a



Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001916
PNG
(4-Phenyl-piperazine-2-carboxylic acid (4-methanesu...)
Show SMILES CS(=O)(=O)Nc1ccc(NC(=O)C2CN(CCN2)c2ccccc2)cc1
Show InChI InChI=1S/C18H22N4O3S/c1-26(24,25)21-15-9-7-14(8-10-15)20-18(23)17-13-22(12-11-19-17)16-5-3-2-4-6-16/h2-10,17,19,21H,11-13H2,1H3,(H,20,23)
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Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001899
PNG
(1-(4-Piperazin-1-yl-phenyl)-ethanone | CHEMBL16633...)
Show SMILES CC(=O)c1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C12H16N2O/c1-10(15)11-2-4-12(5-3-11)14-8-6-13-7-9-14/h2-5,13H,6-9H2,1H3
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Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (human))
BDBM50001899
PNG
(1-(4-Piperazin-1-yl-phenyl)-ethanone | CHEMBL16633...)
Show SMILES CC(=O)c1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C12H16N2O/c1-10(15)11-2-4-12(5-3-11)14-8-6-13-7-9-14/h2-5,13H,6-9H2,1H3
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Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity for Beta-1 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine ventricular...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001911
PNG
(1-p-Tolyl-piperazine | CHEMBL165462)
Show SMILES Cc1ccc(cc1)N1CCNCC1
Show InChI InChI=1S/C11H16N2/c1-10-2-4-11(5-3-10)13-8-6-12-7-9-13/h2-5,12H,6-9H2,1H3
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Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001898
PNG
(1-Phenyl-piperazine | CHEMBL9434 | PHENYLPIPERAZIN...)
Show SMILES C1CN(CCN1)c1ccccc1
Show InChI InChI=1S/C10H14N2/c1-2-4-10(5-3-1)12-8-6-11-7-9-12/h1-5,11H,6-9H2
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Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


Citation and Details
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Canis familiaris)
BDBM50001916
PNG
(4-Phenyl-piperazine-2-carboxylic acid (4-methanesu...)
Show SMILES CS(=O)(=O)Nc1ccc(NC(=O)C2CN(CCN2)c2ccccc2)cc1
Show InChI InChI=1S/C18H22N4O3S/c1-26(24,25)21-15-9-7-14(8-10-15)20-18(23)17-13-22(12-11-19-17)16-5-3-2-4-6-16/h2-10,17,19,21H,11-13H2,1H3,(H,20,23)
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Berlex Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards Beta-2 adrenergic receptor by displacing [3H]dihydroalprenolol, in partially purified membrane fractions from canine lung ti...


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