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PubMed code 7910217

Compile data set for download or QSAR
Found 36 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


(Rattus norvegicus (Rat))
BDBM50036835
PNG
(1-(3,4-Dichloro-phenyl)-2-isopropylamino-ethanol |...)
Show SMILES CC(C)NCC(O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C11H15Cl2NO/c1-7(2)14-6-11(15)8-3-4-9(12)10(13)5-8/h3-5,7,11,14-15H,6H2,1-2H3
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51n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding affinity against beta1-adrenergic receptor in rat brain


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(BOVINE)
BDBM50036835
PNG
(1-(3,4-Dichloro-phenyl)-2-isopropylamino-ethanol |...)
Show SMILES CC(C)NCC(O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C11H15Cl2NO/c1-7(2)14-6-11(15)8-3-4-9(12)10(13)5-8/h3-5,7,11,14-15H,6H2,1-2H3
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140n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding afinity against beta2-adrenergic receptor in bovine lung


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50036840
PNG
(CHEMBL38033 | Propionaldehyde O-(3-tert-butylamino...)
Show SMILES CC\C=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C10H22N2O2/c1-5-6-12-14-8-9(13)7-11-10(2,3)4/h6,9,11,13H,5,7-8H2,1-4H3/b12-6+
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500n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding affinity against beta1-adrenergic receptor in rat brain


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50036838
PNG
(Acetaldehyde O-(3-tert-butylamino-2-hydroxy-propyl...)
Show SMILES C\C=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C9H20N2O2/c1-5-11-13-7-8(12)6-10-9(2,3)4/h5,8,10,12H,6-7H2,1-4H3/b11-5+
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760n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding affinity against beta1-adrenergic receptor in rat brain


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50036842
PNG
(3-tert-Butylamino-2-hydroxy-propionaldehyde O-prop...)
Show SMILES CCCO\N=C\C(O)CNC(C)(C)C
Show InChI InChI=1S/C10H22N2O2/c1-5-6-14-12-8-9(13)7-11-10(2,3)4/h8-9,11,13H,5-7H2,1-4H3/b12-8+
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850n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding affinity against beta1-adrenergic receptor in rat brain


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(BOVINE)
BDBM50036842
PNG
(3-tert-Butylamino-2-hydroxy-propionaldehyde O-prop...)
Show SMILES CCCO\N=C\C(O)CNC(C)(C)C
Show InChI InChI=1S/C10H22N2O2/c1-5-6-14-12-8-9(13)7-11-10(2,3)4/h8-9,11,13H,5-7H2,1-4H3/b12-8+
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850n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding afinity against beta2-adrenergic receptor in bovine lung


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50036839
PNG
(2-Hydroxy-3-isopropylamino-propionaldehyde O-ethyl...)
Show SMILES CCO\N=C\C(O)CNC(C)C
Show InChI InChI=1S/C8H18N2O2/c1-4-12-10-6-8(11)5-9-7(2)3/h6-9,11H,4-5H2,1-3H3/b10-6+
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1.04E+3n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding affinity against beta1-adrenergic receptor in rat brain


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50036841
PNG
(3-tert-Butylamino-2-hydroxy-propionaldehyde O-ethy...)
Show SMILES CCO\N=C\C(O)CNC(C)(C)C
Show InChI InChI=1S/C9H20N2O2/c1-5-13-11-7-8(12)6-10-9(2,3)4/h7-8,10,12H,5-6H2,1-4H3/b11-7+
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1.08E+3n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding affinity against beta1-adrenergic receptor in rat brain


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50036837
PNG
(2-Hydroxy-3-isopropylamino-propionaldehyde O-propy...)
Show SMILES CCCO\N=C\C(O)CNC(C)C
Show InChI InChI=1S/C9H20N2O2/c1-4-5-13-11-7-9(12)6-10-8(2)3/h7-10,12H,4-6H2,1-3H3/b11-7+
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1.24E+3n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding affinity against beta1-adrenergic receptor in rat brain


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(BOVINE)
BDBM50036840
PNG
(CHEMBL38033 | Propionaldehyde O-(3-tert-butylamino...)
Show SMILES CC\C=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C10H22N2O2/c1-5-6-12-14-8-9(13)7-11-10(2,3)4/h6,9,11,13H,5,7-8H2,1-4H3/b12-6+
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1.26E+3n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding afinity against beta2-adrenergic receptor in bovine lung


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(BOVINE)
BDBM50036841
PNG
(3-tert-Butylamino-2-hydroxy-propionaldehyde O-ethy...)
Show SMILES CCO\N=C\C(O)CNC(C)(C)C
Show InChI InChI=1S/C9H20N2O2/c1-5-13-11-7-8(12)6-10-9(2,3)4/h7-8,10,12H,5-6H2,1-4H3/b11-7+
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1.40E+3n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding afinity against beta2-adrenergic receptor in bovine lung


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50036843
PNG
(Acetaldehyde O-(2-hydroxy-3-isopropylamino-propyl)...)
Show SMILES C\C=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C8H18N2O2/c1-4-10-12-6-8(11)5-9-7(2)3/h4,7-9,11H,5-6H2,1-3H3/b10-4+
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1.48E+3n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding affinity against beta1-adrenergic receptor in rat brain


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(BOVINE)
BDBM50036838
PNG
(Acetaldehyde O-(3-tert-butylamino-2-hydroxy-propyl...)
Show SMILES C\C=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C9H20N2O2/c1-5-11-13-7-8(12)6-10-9(2,3)4/h5,8,10,12H,6-7H2,1-4H3/b11-5+
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1.98E+3n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding afinity against beta2-adrenergic receptor in bovine lung


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50036836
PNG
(CHEMBL38114 | Propionaldehyde O-(2-hydroxy-3-isopr...)
Show SMILES CC\C=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C9H20N2O2/c1-4-5-11-13-7-9(12)6-10-8(2)3/h5,8-10,12H,4,6-7H2,1-3H3/b11-5+
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2.20E+3n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding affinity against beta1-adrenergic receptor in rat brain


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(BOVINE)
BDBM50036839
PNG
(2-Hydroxy-3-isopropylamino-propionaldehyde O-ethyl...)
Show SMILES CCO\N=C\C(O)CNC(C)C
Show InChI InChI=1S/C8H18N2O2/c1-4-12-10-6-8(11)5-9-7(2)3/h6-9,11H,4-5H2,1-3H3/b10-6+
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3.50E+3n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding afinity against beta2-adrenergic receptor in bovine lung


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(BOVINE)
BDBM50036836
PNG
(CHEMBL38114 | Propionaldehyde O-(2-hydroxy-3-isopr...)
Show SMILES CC\C=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C9H20N2O2/c1-4-5-11-13-7-9(12)6-10-8(2)3/h5,8-10,12H,4,6-7H2,1-3H3/b11-5+
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4.58E+3n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding afinity against beta2-adrenergic receptor in bovine lung


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(BOVINE)
BDBM50036837
PNG
(2-Hydroxy-3-isopropylamino-propionaldehyde O-propy...)
Show SMILES CCCO\N=C\C(O)CNC(C)C
Show InChI InChI=1S/C9H20N2O2/c1-4-5-13-11-7-9(12)6-10-8(2)3/h7-10,12H,4-6H2,1-3H3/b11-7+
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5.60E+3n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding afinity against beta2-adrenergic receptor in bovine lung


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(BOVINE)
BDBM50036843
PNG
(Acetaldehyde O-(2-hydroxy-3-isopropylamino-propyl)...)
Show SMILES C\C=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C8H18N2O2/c1-4-10-12-6-8(11)5-9-7(2)3/h4,7-9,11H,5-6H2,1-3H3/b10-4+
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7.20E+3n/an/an/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Binding afinity against beta2-adrenergic receptor in bovine lung


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50036835
PNG
(1-(3,4-Dichloro-phenyl)-2-isopropylamino-ethanol |...)
Show SMILES CC(C)NCC(O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C11H15Cl2NO/c1-7(2)14-6-11(15)8-3-4-9(12)10(13)5-8/h3-5,7,11,14-15H,6H2,1-2H3
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n/an/a 115n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-1-adrenergic receptor in isolated guinea pig atria


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036842
PNG
(3-tert-Butylamino-2-hydroxy-propionaldehyde O-prop...)
Show SMILES CCCO\N=C\C(O)CNC(C)(C)C
Show InChI InChI=1S/C10H22N2O2/c1-5-6-14-12-8-9(13)7-11-10(2,3)4/h8-9,11,13H,5-7H2,1-4H3/b12-8+
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n/an/a 269n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036841
PNG
(3-tert-Butylamino-2-hydroxy-propionaldehyde O-ethy...)
Show SMILES CCO\N=C\C(O)CNC(C)(C)C
Show InChI InChI=1S/C9H20N2O2/c1-5-13-11-7-8(12)6-10-9(2,3)4/h7-8,10,12H,5-6H2,1-4H3/b11-7+
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n/an/a 977n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036835
PNG
(1-(3,4-Dichloro-phenyl)-2-isopropylamino-ethanol |...)
Show SMILES CC(C)NCC(O)c1ccc(Cl)c(Cl)c1
Show InChI InChI=1S/C11H15Cl2NO/c1-7(2)14-6-11(15)8-3-4-9(12)10(13)5-8/h3-5,7,11,14-15H,6H2,1-2H3
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n/an/a 977n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036840
PNG
(CHEMBL38033 | Propionaldehyde O-(3-tert-butylamino...)
Show SMILES CC\C=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C10H22N2O2/c1-5-6-12-14-8-9(13)7-11-10(2,3)4/h6,9,11,13H,5,7-8H2,1-4H3/b12-6+
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n/an/a 1.55E+3n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036839
PNG
(2-Hydroxy-3-isopropylamino-propionaldehyde O-ethyl...)
Show SMILES CCO\N=C\C(O)CNC(C)C
Show InChI InChI=1S/C8H18N2O2/c1-4-12-10-6-8(11)5-9-7(2)3/h6-9,11H,4-5H2,1-3H3/b10-6+
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n/an/a 3.31E+3n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036838
PNG
(Acetaldehyde O-(3-tert-butylamino-2-hydroxy-propyl...)
Show SMILES C\C=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C9H20N2O2/c1-5-11-13-7-8(12)6-10-9(2,3)4/h5,8,10,12H,6-7H2,1-4H3/b11-5+
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n/an/a 4.07E+3n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036837
PNG
(2-Hydroxy-3-isopropylamino-propionaldehyde O-propy...)
Show SMILES CCCO\N=C\C(O)CNC(C)C
Show InChI InChI=1S/C9H20N2O2/c1-4-5-13-11-7-9(12)6-10-8(2)3/h7-10,12H,4-6H2,1-3H3/b11-7+
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n/an/a 4.37E+3n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50036842
PNG
(3-tert-Butylamino-2-hydroxy-propionaldehyde O-prop...)
Show SMILES CCCO\N=C\C(O)CNC(C)(C)C
Show InChI InChI=1S/C10H22N2O2/c1-5-6-14-12-8-9(13)7-11-10(2,3)4/h8-9,11,13H,5-7H2,1-4H3/b12-8+
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n/an/a 8.32E+3n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-1-adrenergic receptor in isolated guinea pig atria


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036836
PNG
(CHEMBL38114 | Propionaldehyde O-(2-hydroxy-3-isopr...)
Show SMILES CC\C=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C9H20N2O2/c1-4-5-11-13-7-9(12)6-10-8(2)3/h5,8-10,12H,4,6-7H2,1-3H3/b11-5+
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n/an/a 1.20E+4n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50036839
PNG
(2-Hydroxy-3-isopropylamino-propionaldehyde O-ethyl...)
Show SMILES CCO\N=C\C(O)CNC(C)C
Show InChI InChI=1S/C8H18N2O2/c1-4-12-10-6-8(11)5-9-7(2)3/h6-9,11H,4-5H2,1-3H3/b10-6+
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n/an/a 1.23E+4n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-1-adrenergic receptor in isolated guinea pig atria


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50036843
PNG
(Acetaldehyde O-(2-hydroxy-3-isopropylamino-propyl)...)
Show SMILES C\C=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C8H18N2O2/c1-4-10-12-6-8(11)5-9-7(2)3/h4,7-9,11H,5-6H2,1-3H3/b10-4+
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n/an/a 1.29E+4n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-2-adrenergic receptor in isolated guinea pig tracheal strips


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50036838
PNG
(Acetaldehyde O-(3-tert-butylamino-2-hydroxy-propyl...)
Show SMILES C\C=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C9H20N2O2/c1-5-11-13-7-8(12)6-10-9(2,3)4/h5,8,10,12H,6-7H2,1-4H3/b11-5+
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n/an/a 1.35E+4n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-1-adrenergic receptor in isolated guinea pig atria


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50036841
PNG
(3-tert-Butylamino-2-hydroxy-propionaldehyde O-ethy...)
Show SMILES CCO\N=C\C(O)CNC(C)(C)C
Show InChI InChI=1S/C9H20N2O2/c1-5-13-11-7-8(12)6-10-9(2,3)4/h7-8,10,12H,5-6H2,1-4H3/b11-7+
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n/an/a 1.38E+4n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-1-adrenergic receptor in isolated guinea pig atria


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50036836
PNG
(CHEMBL38114 | Propionaldehyde O-(2-hydroxy-3-isopr...)
Show SMILES CC\C=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C9H20N2O2/c1-4-5-11-13-7-9(12)6-10-8(2)3/h5,8-10,12H,4,6-7H2,1-3H3/b11-5+
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n/an/a 1.55E+4n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-1-adrenergic receptor in isolated guinea pig atria


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50036837
PNG
(2-Hydroxy-3-isopropylamino-propionaldehyde O-propy...)
Show SMILES CCCO\N=C\C(O)CNC(C)C
Show InChI InChI=1S/C9H20N2O2/c1-4-5-13-11-7-9(12)6-10-8(2)3/h7-10,12H,4-6H2,1-3H3/b11-7+
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n/an/a 1.55E+4n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-1-adrenergic receptor in isolated guinea pig atria


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50036840
PNG
(CHEMBL38033 | Propionaldehyde O-(3-tert-butylamino...)
Show SMILES CC\C=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C10H22N2O2/c1-5-6-12-14-8-9(13)7-11-10(2,3)4/h6,9,11,13H,5,7-8H2,1-4H3/b12-6+
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n/an/a 2.63E+4n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-1-adrenergic receptor in isolated guinea pig atria


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50036843
PNG
(Acetaldehyde O-(2-hydroxy-3-isopropylamino-propyl)...)
Show SMILES C\C=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C8H18N2O2/c1-4-10-12-6-8(11)5-9-7(2)3/h4,7-9,11H,5-6H2,1-3H3/b10-4+
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n/an/a 3.02E+4n/an/an/an/an/an/a



Universitá di Pisa

Curated by ChEMBL


Assay Description
Inhibitory concentration against beta-1-adrenergic receptor in isolated guinea pig atria


J Med Chem 37: 1518-25 (1994)


BindingDB Entry DOI: 10.7270/Q2V69HM4
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%