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Compile Data Set for Download or QSAR

Found 137 hits of kd data for polymerid = 49000249   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50292219
PNG
((-)-3-morpholino-4-(3-tert-butylamino-2-hydroxypro...)
Show SMILES CC(C)(C)NC[C@H](O)COc1nsnc1N1CCOCC1 |r|
Show InChI InChI=1S/C13H24N4O3S/c1-13(2,3)14-8-10(18)9-20-12-11(15-21-16-12)17-4-6-19-7-5-17/h10,14,18H,4-9H2,1-3H3/t10-/m0/s1
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n/an/an/a 0.240n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro beta-2 adrenergic receptor activity was determined by measuring inhibition of the isoproterenol induced relaxation in isolated guinea pig tr...

J Med Chem 26: 950-7 (1983)


BindingDB Entry DOI: 10.7270/Q2GH9K4C
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50365058
PNG
(CHEMBL1951067)
Show SMILES COc1ccc(cc1OC)C1=NN(CCCCNC[C@H](O)c2ccc(O)c(NC=O)c2)C(=O)C2CCCCC12 |r,t:11|
Show InChI InChI=1S/C29H38N4O6/c1-38-26-12-10-20(16-27(26)39-2)28-21-7-3-4-8-22(21)29(37)33(32-28)14-6-5-13-30-17-25(36)19-9-11-24(35)23(15-19)31-18-34/h9-12,15-16,18,21-22,25,30,35-36H,3-8,13-14,17H2,1-2H3,(H,31,34)/t21?,22?,25-/m0/s1
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n/an/an/a 0.708n/an/an/an/an/a



Sun Yat-sen University

Curated by ChEMBL


Assay Description
Competitive antagonist activity at beta2-adrenoreceptor in guinea pig tracheal ring in the presence of N-(5-((1R)-2-(4-(4-(3,4-dimethoxyphenol)-1-oxo...

Bioorg Med Chem Lett 22: 1523-6 (2012)


Article DOI: 10.1016/j.bmcl.2012.01.013
BindingDB Entry DOI: 10.7270/Q2794548
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404804
PNG
(CHEMBL13365)
Show SMILES COC(=O)c1ccccc1OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C15H23NO4/c1-15(2,3)16-9-11(17)10-20-13-8-6-5-7-12(13)14(18)19-4/h5-8,11,16-17H,9-10H2,1-4H3
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n/an/an/a 1.26n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to block Beta-2 adrenergic receptor in guinea pig trachea preparation

J Med Chem 25: 1408-12 (1983)


BindingDB Entry DOI: 10.7270/Q2S183PB
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM81886
PNG
(CAS_3506-09-0 | CHEMBL287651 | PROPRANOLOL, dl)
Show SMILES CC(C)CNCC(O)COc1cccc2ccccc12
Show InChI InChI=1S/C17H23NO2/c1-13(2)10-18-11-15(19)12-20-17-9-5-7-14-6-3-4-8-16(14)17/h3-9,13,15,18-19H,10-12H2,1-2H3
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n/an/an/a 1.26n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro ability to block beta-2 adrenergic receptor in guinea pig trachea.

J Med Chem 25: 1402-7 (1983)


BindingDB Entry DOI: 10.7270/Q2WQ0500
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404808
PNG
(CHEMBL281967)
Show SMILES COC(=O)CCc1ccccc1OCC(O)CNC(C)C
Show InChI InChI=1S/C16H25NO4/c1-12(2)17-10-14(18)11-21-15-7-5-4-6-13(15)8-9-16(19)20-3/h4-7,12,14,17-18H,8-11H2,1-3H3
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n/an/an/a 1.26n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to block Beta-2 adrenergic receptor in guinea pig trachea preparation

J Med Chem 25: 1408-12 (1983)


BindingDB Entry DOI: 10.7270/Q2S183PB
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM25761
PNG
(Anapriline | Avlocardyl | CHEMBL27 | PROPANOLOL(-)...)
Show SMILES CC(C)NCC(O)COc1cccc2ccccc12
Show InChI InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3
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n/an/an/a 1.26n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to block Beta-2 adrenergic receptor in guinea pig trachea preparation

J Med Chem 25: 1408-12 (1983)


BindingDB Entry DOI: 10.7270/Q2S183PB
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404805
PNG
(CHEMBL281294)
Show SMILES CCOC(=O)c1ccccc1OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C16H25NO4/c1-5-20-15(19)13-8-6-7-9-14(13)21-11-12(18)10-17-16(2,3)4/h6-9,12,17-18H,5,10-11H2,1-4H3
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n/an/an/a 1.60n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to block Beta-2 adrenergic receptor in guinea pig trachea preparation

J Med Chem 25: 1408-12 (1983)


BindingDB Entry DOI: 10.7270/Q2S183PB
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50405013
PNG
(CHEMBL285972)
Show SMILES [#6]C([#6])([#6])[#7]-[#6]-[#6](-[#8])-[#6]-[#8]\[#7]=[#6](/[#6]-1-[#6]-[#6]1)-[#6]-1-[#6]-[#6]-1
Show InChI InChI=1S/C14H26N2O2/c1-14(2,3)15-8-12(17)9-18-16-13(10-4-5-10)11-6-7-11/h10-12,15,17H,4-9H2,1-3H3
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n/an/an/a 2.14n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking activity in trachea of guinea pig.

J Med Chem 27: 1291-4 (1984)


BindingDB Entry DOI: 10.7270/Q23779W0
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM25761
PNG
(Anapriline | Avlocardyl | CHEMBL27 | PROPANOLOL(-)...)
Show SMILES CC(C)NCC(O)COc1cccc2ccccc12
Show InChI InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3
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n/an/an/a 3.02n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro beta-2 adrenergic receptor activity was determined by measuring inhibition of the isoproterenol induced relaxation in isolated guinea pig tr...

J Med Chem 26: 950-7 (1983)


BindingDB Entry DOI: 10.7270/Q2GH9K4C
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM25761
PNG
(Anapriline | Avlocardyl | CHEMBL27 | PROPANOLOL(-)...)
Show SMILES CC(C)NCC(O)COc1cccc2ccccc12
Show InChI InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3
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n/an/an/a 3.39n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking activity in trachea of guinea pig.

J Med Chem 27: 1291-4 (1984)


BindingDB Entry DOI: 10.7270/Q23779W0
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM25761
PNG
(Anapriline | Avlocardyl | CHEMBL27 | PROPANOLOL(-)...)
Show SMILES CC(C)NCC(O)COc1cccc2ccccc12
Show InChI InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3
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n/an/an/a 3.39n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The apparent pA2 value was measured for beta-2 adrenergic blocking activity on the trachea of guinea pig

J Med Chem 23: 620-4 (1980)


BindingDB Entry DOI: 10.7270/Q2Q52QT2
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50060974
PNG
(CHEMBL3393402)
Show SMILES CC(C)C[B-]1(O)OCc2cc(ccc2O1)[C@@H](O)C[NH2+]C(C)(C)C |r|
Show InChI InChI=1S/C17H29BNO4/c1-12(2)9-18(21)22-11-14-8-13(6-7-16(14)23-18)15(20)10-19-17(3,4)5/h6-8,12,15,19-21H,9-11H2,1-5H3/q-1/p+1/t15-,18?/m0/s1
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n/an/an/a 5.10n/an/an/an/an/a



Instituto Polit£cnico Nacional

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in Hartley guinea pig tracheal ring at basal tone assessed as bronchorelaxation activity

Bioorg Med Chem Lett 25: 820-5 (2015)


Article DOI: 10.1016/j.bmcl.2014.12.077
BindingDB Entry DOI: 10.7270/Q2FN17W4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404770
PNG
(CHEMBL31021)
Show SMILES CC(C)CNCC(O)COc1ccccc1C
Show InChI InChI=1S/C14H23NO2/c1-11(2)8-15-9-13(16)10-17-14-7-5-4-6-12(14)3/h4-7,11,13,15-16H,8-10H2,1-3H3
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n/an/an/a 6.31n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro ability to block beta-2 adrenergic receptor in guinea pig trachea.

J Med Chem 25: 1402-7 (1983)


BindingDB Entry DOI: 10.7270/Q2WQ0500
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404785
PNG
(CHEMBL31529)
Show SMILES CCOC(=O)CC(C)(C)NCC(O)COc1ccccc1C
Show InChI InChI=1S/C17H27NO4/c1-5-21-16(20)10-17(3,4)18-11-14(19)12-22-15-9-7-6-8-13(15)2/h6-9,14,18-19H,5,10-12H2,1-4H3
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n/an/an/a 7.94n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro ability to block beta-2 adrenergic receptor in guinea pig trachea.

J Med Chem 25: 1402-7 (1983)


BindingDB Entry DOI: 10.7270/Q2WQ0500
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50405012
PNG
(CHEMBL24644)
Show SMILES CC(C)(C)NCC(O)CO\N=C(\CC(=O)C(C)(C)C)C1CC1
Show InChI InChI=1S/C17H32N2O3/c1-16(2,3)15(21)9-14(12-7-8-12)19-22-11-13(20)10-18-17(4,5)6/h12-13,18,20H,7-11H2,1-6H3/b19-14-
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n/an/an/a 8.91n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking activity in trachea of guinea pig.

J Med Chem 27: 1291-4 (1984)


BindingDB Entry DOI: 10.7270/Q23779W0
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404987
PNG
(CHEMBL3085291)
Show SMILES CC(C)(C)NC[C@H](O)COc1ccc(cc1)-c1nc(c[nH]1)C(F)(F)F |r|
Show InChI InChI=1S/C17H22F3N3O2/c1-16(2,3)22-8-12(24)10-25-13-6-4-11(5-7-13)15-21-9-14(23-15)17(18,19)20/h4-7,9,12,22,24H,8,10H2,1-3H3,(H,21,23)/t12-/m0/s1
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n/an/an/a 8.91n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro beta-2 adrenergic receptor activity was determined by measuring inhibition of the isoproterenol induced relaxation in isolated guinea pig tr...

J Med Chem 26: 950-7 (1983)


BindingDB Entry DOI: 10.7270/Q2GH9K4C
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404488
PNG
(CHEMBL1161386)
Show SMILES C\C(\C=C\c1ccccc1)=N/OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C17H26N2O2/c1-14(10-11-15-8-6-5-7-9-15)19-21-13-16(20)12-18-17(2,3)4/h5-11,16,18,20H,12-13H2,1-4H3/b11-10+,19-14+
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n/an/an/a 9.55n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The apparent pA2 value was measured for beta-2 adrenergic blocking activity on the trachea of guinea pig

J Med Chem 23: 620-4 (1980)


BindingDB Entry DOI: 10.7270/Q2Q52QT2
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50405017
PNG
(CHEMBL24045)
Show SMILES C\C(=N\OCC(O)CNC(C)(C)C)C1CC1
Show InChI InChI=1S/C12H24N2O2/c1-9(10-5-6-10)14-16-8-11(15)7-13-12(2,3)4/h10-11,13,15H,5-8H2,1-4H3/b14-9-
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n/an/an/a 12.6n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking activity in trachea of guinea pig.

J Med Chem 27: 1291-4 (1984)


BindingDB Entry DOI: 10.7270/Q23779W0
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404790
PNG
(CHEMBL13284)
Show SMILES COC(=O)c1ccccc1OCC(O)CNC(C)C
Show InChI InChI=1S/C14H21NO4/c1-10(2)15-8-11(16)9-19-13-7-5-4-6-12(13)14(17)18-3/h4-7,10-11,15-16H,8-9H2,1-3H3
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n/an/an/a 12.6n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to block Beta-2 adrenergic receptor in guinea pig trachea preparation

J Med Chem 25: 1408-12 (1983)


BindingDB Entry DOI: 10.7270/Q2S183PB
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404787
PNG
(CHEMBL284909)
Show SMILES CC(C)NCC(O)COc1ccccc1C(=O)OC=C
Show InChI InChI=1S/C15H21NO4/c1-4-19-15(18)13-7-5-6-8-14(13)20-10-12(17)9-16-11(2)3/h4-8,11-12,16-17H,1,9-10H2,2-3H3
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n/an/an/a 12.6n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to block Beta-2 adrenergic receptor in guinea pig trachea preparation

J Med Chem 25: 1408-12 (1983)


BindingDB Entry DOI: 10.7270/Q2S183PB
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404807
PNG
(CHEMBL31335)
Show SMILES CCOC(=O)C(C)(C)NCC(O)COc1ccccc1C(=O)OC
Show InChI InChI=1S/C17H25NO6/c1-5-23-16(21)17(2,3)18-10-12(19)11-24-14-9-7-6-8-13(14)15(20)22-4/h6-9,12,18-19H,5,10-11H2,1-4H3
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n/an/an/a 15.8n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to block Beta-2 adrenergic receptor in guinea pig trachea preparation

J Med Chem 25: 1408-12 (1983)


BindingDB Entry DOI: 10.7270/Q2S183PB
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50405018
PNG
(CHEMBL24500)
Show SMILES CC1C\C(CC(C)(C)C1)=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C16H32N2O2/c1-12-7-13(9-16(5,6)8-12)18-20-11-14(19)10-17-15(2,3)4/h12,14,17,19H,7-11H2,1-6H3/b18-13-
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n/an/an/a 16.6n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking activity in trachea of guinea pig.

J Med Chem 27: 1291-4 (1984)


BindingDB Entry DOI: 10.7270/Q23779W0
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM25392
PNG
(4-[1-hydroxy-2-(isopropylamino)ethyl]pyrocatechol;...)
Show SMILES CC(C)NCC(O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C11H17NO3/c1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8/h3-5,7,11-15H,6H2,1-2H3
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n/an/an/a 18n/an/an/an/an/a



Instituto Polit£cnico Nacional

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in Hartley guinea pig tracheal ring assessed as bronchorelaxation activity against histamine-induced co...

Bioorg Med Chem Lett 25: 820-5 (2015)


Article DOI: 10.1016/j.bmcl.2014.12.077
BindingDB Entry DOI: 10.7270/Q2FN17W4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404492
PNG
(CHEMBL155714)
Show SMILES CC(C)NCC(O)CO\N=C(\C)CCc1ccccc1
Show InChI InChI=1S/C16H26N2O2/c1-13(2)17-11-16(19)12-20-18-14(3)9-10-15-7-5-4-6-8-15/h4-8,13,16-17,19H,9-12H2,1-3H3/b18-14-
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n/an/an/a 20.9n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The apparent pA2 value was measured for beta-2 adrenergic blocking activity on the trachea of guinea pig

J Med Chem 23: 620-4 (1980)


BindingDB Entry DOI: 10.7270/Q2Q52QT2
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50405014
PNG
(CHEMBL24480)
Show SMILES [#6]\[#6](-[#6])=[#7]\[#8]-[#6]-[#6](-[#8])-[#6]-[#7]C([#6])([#6])[#6]
Show InChI InChI=1S/C10H22N2O2/c1-8(2)12-14-7-9(13)6-11-10(3,4)5/h9,11,13H,6-7H2,1-5H3
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n/an/an/a 22.4n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking activity in trachea of guinea pig.

J Med Chem 27: 1291-4 (1984)


BindingDB Entry DOI: 10.7270/Q23779W0
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404502
PNG
(CHEMBL555848)
Show SMILES [#6]\[#6](-[#6])=[#7]/[#8]-[#6]-[#6](-[#8])-[#6]-[#7]C([#6])([#6])[#6]
Show InChI InChI=1S/C10H22N2O2/c1-8(2)12-14-7-9(13)6-11-10(3,4)5/h9,11,13H,6-7H2,1-5H3
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n/an/an/a 22.4n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The apparent pA2 value was measured for beta-2 adrenergic blocking activity on the trachea of guinea pig

J Med Chem 23: 620-4 (1980)


BindingDB Entry DOI: 10.7270/Q2Q52QT2
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50405011
PNG
(CHEMBL26059)
Show SMILES CC(C)(C)COCC(O)CNC(C)(C)C
Show InChI InChI=1S/C12H27NO2/c1-11(2,3)9-15-8-10(14)7-13-12(4,5)6/h10,13-14H,7-9H2,1-6H3
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n/an/an/a 22.9n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking activity in trachea of guinea pig.

J Med Chem 27: 1291-4 (1984)


BindingDB Entry DOI: 10.7270/Q23779W0
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM25392
PNG
(4-[1-hydroxy-2-(isopropylamino)ethyl]pyrocatechol;...)
Show SMILES CC(C)NCC(O)c1ccc(O)c(O)c1
Show InChI InChI=1S/C11H17NO3/c1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8/h3-5,7,11-15H,6H2,1-2H3
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n/an/an/a 25n/an/an/an/an/a



Instituto Polit£cnico Nacional

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in Hartley guinea pig tracheal ring at basal tone assessed as bronchorelaxation activity

Bioorg Med Chem Lett 25: 820-5 (2015)


Article DOI: 10.1016/j.bmcl.2014.12.077
BindingDB Entry DOI: 10.7270/Q2FN17W4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50060974
PNG
(CHEMBL3393402)
Show SMILES CC(C)C[B-]1(O)OCc2cc(ccc2O1)[C@@H](O)C[NH2+]C(C)(C)C |r|
Show InChI InChI=1S/C17H29BNO4/c1-12(2)9-18(21)22-11-14-8-13(6-7-16(14)23-18)15(20)10-19-17(3,4)5/h6-8,12,15,19-21H,9-11H2,1-5H3/q-1/p+1/t15-,18?/m0/s1
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n/an/an/a 28n/an/an/an/an/a



Instituto Polit£cnico Nacional

Curated by ChEMBL


Assay Description
Agonist activity at adrenergic beta2 receptor in Hartley guinea pig tracheal ring assessed as bronchorelaxation activity against histamine-induced co...

Bioorg Med Chem Lett 25: 820-5 (2015)


Article DOI: 10.1016/j.bmcl.2014.12.077
BindingDB Entry DOI: 10.7270/Q2FN17W4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404487
PNG
(CHEMBL156871)
Show SMILES C\C(CCc1ccccc1)=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C17H28N2O2/c1-14(10-11-15-8-6-5-7-9-15)19-21-13-16(20)12-18-17(2,3)4/h5-9,16,18,20H,10-13H2,1-4H3/b19-14-
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n/an/an/a 30.2n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The apparent pA2 value was measured for beta-2 adrenergic blocking activity on the trachea of guinea pig

J Med Chem 23: 620-4 (1980)


BindingDB Entry DOI: 10.7270/Q2Q52QT2
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404484
PNG
(CHEMBL1161388 | CHEMBL26003)
Show SMILES CC(C)COCC(O)CNC(C)(C)C
Show InChI InChI=1S/C11H25NO2/c1-9(2)7-14-8-10(13)6-12-11(3,4)5/h9-10,12-13H,6-8H2,1-5H3
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n/an/an/a 32.4n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking activity in trachea of guinea pig.

J Med Chem 27: 1291-4 (1984)


BindingDB Entry DOI: 10.7270/Q23779W0
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404484
PNG
(CHEMBL1161388 | CHEMBL26003)
Show SMILES CC(C)COCC(O)CNC(C)(C)C
Show InChI InChI=1S/C11H25NO2/c1-9(2)7-14-8-10(13)6-12-11(3,4)5/h9-10,12-13H,6-8H2,1-5H3
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n/an/an/a 32.4n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The apparent pA2 value was measured for beta-2 adrenergic blocking activity on the trachea of guinea pig

J Med Chem 23: 620-4 (1980)


BindingDB Entry DOI: 10.7270/Q2Q52QT2
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404982
PNG
(CHEMBL366769)
Show SMILES CC(C)(C)NCC(O)COc1ccc(cc1)-c1nc(c[nH]1)-c1cccs1
Show InChI InChI=1S/C20H25N3O2S/c1-20(2,3)22-11-15(24)13-25-16-8-6-14(7-9-16)19-21-12-17(23-19)18-5-4-10-26-18/h4-10,12,15,22,24H,11,13H2,1-3H3,(H,21,23)
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n/an/an/a 33.1n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro beta-2 adrenergic receptor activity was determined by measuring inhibition of the isoproterenol induced relaxation in isolated guinea pig tr...

J Med Chem 26: 950-7 (1983)


BindingDB Entry DOI: 10.7270/Q2GH9K4C
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404784
PNG
(CHEMBL31811)
Show SMILES CC(C)CNCC(O)COc1ccccc1
Show InChI InChI=1S/C13H21NO2/c1-11(2)8-14-9-12(15)10-16-13-6-4-3-5-7-13/h3-7,11-12,14-15H,8-10H2,1-2H3
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n/an/an/a 39.8n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro ability to block beta-2 adrenergic receptor in guinea pig trachea.

J Med Chem 25: 1402-7 (1983)


BindingDB Entry DOI: 10.7270/Q2WQ0500
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404783
PNG
(CHEMBL32902)
Show SMILES CCOC(=O)CCCCNCC(O)COc1ccccc1C
Show InChI InChI=1S/C17H27NO4/c1-3-21-17(20)10-6-7-11-18-12-15(19)13-22-16-9-5-4-8-14(16)2/h4-5,8-9,15,18-19H,3,6-7,10-13H2,1-2H3
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n/an/an/a 39.8n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro ability to block beta-2 adrenergic receptor in guinea pig trachea.

J Med Chem 25: 1402-7 (1983)


BindingDB Entry DOI: 10.7270/Q2WQ0500
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404810
PNG
(CHEMBL281298)
Show SMILES COC(=O)c1ccccc1OCC(O)CNC(C)(C)CO
Show InChI InChI=1S/C15H23NO5/c1-15(2,10-17)16-8-11(18)9-21-13-7-5-4-6-12(13)14(19)20-3/h4-7,11,16-18H,8-10H2,1-3H3
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n/an/an/a 39.8n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to block Beta-2 adrenergic receptor in guinea pig trachea preparation

J Med Chem 25: 1408-12 (1983)


BindingDB Entry DOI: 10.7270/Q2S183PB
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404763
PNG
(CHEMBL283289)
Show SMILES CCOC(=O)CCNCC(O)COc1ccccc1C
Show InChI InChI=1S/C15H23NO4/c1-3-19-15(18)8-9-16-10-13(17)11-20-14-7-5-4-6-12(14)2/h4-7,13,16-17H,3,8-11H2,1-2H3
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n/an/an/a 39.8n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro ability to block beta-2 adrenergic receptor in guinea pig trachea.

J Med Chem 25: 1402-7 (1983)


BindingDB Entry DOI: 10.7270/Q2WQ0500
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM25761
PNG
(Anapriline | Avlocardyl | CHEMBL27 | PROPANOLOL(-)...)
Show SMILES CC(C)NCC(O)COc1cccc2ccccc12
Show InChI InChI=1S/C16H21NO2/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16/h3-9,12,14,17-18H,10-11H2,1-2H3
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n/an/an/a 43.6n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonist activity of compound against Beta-2 adrenergic receptor in isolated guinea pig trachea

J Med Chem 24: 994-8 (1982)


BindingDB Entry DOI: 10.7270/Q2JH3ND4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50405015
PNG
(CHEMBL26049)
Show SMILES C\C(CC1CC1)=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C13H26N2O2/c1-10(7-11-5-6-11)15-17-9-12(16)8-14-13(2,3)4/h11-12,14,16H,5-9H2,1-4H3/b15-10-
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n/an/an/a 47.9n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking activity in trachea of guinea pig.

J Med Chem 27: 1291-4 (1984)


BindingDB Entry DOI: 10.7270/Q23779W0
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404776
PNG
(CHEMBL287242)
Show SMILES CCOC(=O)CCNCC(O)COc1cccc2ccccc12
Show InChI InChI=1S/C18H23NO4/c1-2-22-18(21)10-11-19-12-15(20)13-23-17-9-5-7-14-6-3-4-8-16(14)17/h3-9,15,19-20H,2,10-13H2,1H3
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n/an/an/a 50.1n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro ability to block beta-2 adrenergic receptor in guinea pig trachea.

J Med Chem 25: 1402-7 (1983)


BindingDB Entry DOI: 10.7270/Q2WQ0500
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404994
PNG
(CHEMBL2096752)
Show SMILES O[C@@H](CNC1CC1)COc1ccc(cc1)-c1ncc([nH]1)C(F)(F)F |r|
Show InChI InChI=1S/C16H18F3N3O2/c17-16(18,19)14-8-21-15(22-14)10-1-5-13(6-2-10)24-9-12(23)7-20-11-3-4-11/h1-2,5-6,8,11-12,20,23H,3-4,7,9H2,(H,21,22)/t12-/m0/s1
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n/an/an/a 57.5n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro beta-2 adrenergic receptor activity was determined by measuring inhibition of the isoproterenol induced relaxation in isolated guinea pig tr...

J Med Chem 26: 950-7 (1983)


BindingDB Entry DOI: 10.7270/Q2GH9K4C
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404809
PNG
(CHEMBL31450)
Show SMILES CC(C)NCC(O)COc1cccc(c1)C(=O)OC=C
Show InChI InChI=1S/C15H21NO4/c1-4-19-15(18)12-6-5-7-14(8-12)20-10-13(17)9-16-11(2)3/h4-8,11,13,16-17H,1,9-10H2,2-3H3
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n/an/an/a 63.1n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to block Beta-2 adrenergic receptor in guinea pig trachea preparation

J Med Chem 25: 1408-12 (1983)


BindingDB Entry DOI: 10.7270/Q2S183PB
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404813
PNG
(CHEMBL13358)
Show SMILES COC(=O)c1ccccc1OCC(O)CNCCc1ccc(OC)c(OC)c1
Show InChI InChI=1S/C21H27NO6/c1-25-19-9-8-15(12-20(19)26-2)10-11-22-13-16(23)14-28-18-7-5-4-6-17(18)21(24)27-3/h4-9,12,16,22-23H,10-11,13-14H2,1-3H3
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n/an/an/a 79.4n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Ability to block Beta-2 adrenergic receptor in guinea pig trachea preparation

J Med Chem 25: 1408-12 (1983)


BindingDB Entry DOI: 10.7270/Q2S183PB
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50405024
PNG
(CHEMBL286783)
Show SMILES CC(C)(C)NCC(O)CO\N=C/C1CC1
Show InChI InChI=1S/C11H22N2O2/c1-11(2,3)12-7-10(14)8-15-13-6-9-4-5-9/h6,9-10,12,14H,4-5,7-8H2,1-3H3/b13-6-
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n/an/an/a 81.3n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking activity in trachea of guinea pig.

J Med Chem 27: 1291-4 (1984)


BindingDB Entry DOI: 10.7270/Q23779W0
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404498
PNG
(CHEMBL1161383)
Show SMILES [#6]C([#6])([#6])[#7]-[#6]-[#6](-[#8])-[#6]-[#8]\[#7]=[#6]-1\[#6]-[#6]-[#6]-[#6]-[#6]-1
Show InChI InChI=1S/C13H26N2O2/c1-13(2,3)14-9-12(16)10-17-15-11-7-5-4-6-8-11/h12,14,16H,4-10H2,1-3H3
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n/an/an/a 81.3n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
The apparent pA2 value was measured for beta-2 adrenergic blocking activity on the trachea of guinea pig

J Med Chem 23: 620-4 (1980)


BindingDB Entry DOI: 10.7270/Q2Q52QT2
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404696
PNG
(CHEMBL427310)
Show SMILES CC(C)(C)NCC(O)C1=COc2ccccc2O1 |t:8|
Show InChI InChI=1S/C14H19NO3/c1-14(2,3)15-8-10(16)13-9-17-11-6-4-5-7-12(11)18-13/h4-7,9-10,15-16H,8H2,1-3H3
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n/an/an/a 81.3n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonist activity of compound against Beta-2 adrenergic receptor in isolated guinea pig trachea

J Med Chem 24: 994-8 (1982)


BindingDB Entry DOI: 10.7270/Q2JH3ND4
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50405027
PNG
(CHEMBL25929)
Show SMILES CC1CC(CC(C)(C)C1)OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C16H33NO2/c1-12-7-14(9-16(5,6)8-12)19-11-13(18)10-17-15(2,3)4/h12-14,17-18H,7-11H2,1-6H3
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n/an/an/a 97.7n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor blocking activity in trachea of guinea pig.

J Med Chem 27: 1291-4 (1984)


BindingDB Entry DOI: 10.7270/Q23779W0
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404767
PNG
(CHEMBL448775)
Show SMILES COC(=O)CCNCC(O)COc1cccc2ccccc12
Show InChI InChI=1S/C17H21NO4/c1-21-17(20)9-10-18-11-14(19)12-22-16-8-4-6-13-5-2-3-7-15(13)16/h2-8,14,18-19H,9-12H2,1H3
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PubMed
n/an/an/a 100n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro ability to block beta-2 adrenergic receptor in guinea pig trachea.

J Med Chem 25: 1402-7 (1983)


BindingDB Entry DOI: 10.7270/Q2WQ0500
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50404771
PNG
(CHEMBL31938)
Show SMILES COC(=O)CCNCC(O)COc1ccccc1C
Show InChI InChI=1S/C14H21NO4/c1-11-5-3-4-6-13(11)19-10-12(16)9-15-8-7-14(17)18-2/h3-6,12,15-16H,7-10H2,1-2H3
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PubMed
n/an/an/a 100n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro ability to block beta-2 adrenergic receptor in guinea pig trachea.

J Med Chem 25: 1402-7 (1983)


BindingDB Entry DOI: 10.7270/Q2WQ0500
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)		BDBM50405521
PNG
(ALO 1401-02 | ALO-1401-02 | BETAXOLOL HYDROCHLORID...)
Show SMILES CC(C)NCC(O)COc1ccc(CCOCC2CC2)cc1
Show InChI InChI=1S/C18H29NO3/c1-14(2)19-11-17(20)13-22-18-7-5-15(6-8-18)9-10-21-12-16-3-4-16/h5-8,14,16-17,19-20H,3-4,9-13H2,1-2H3
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PubMed
n/an/an/a 105n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro beta-2 adrenergic receptor activity was determined by measuring inhibition of the isoproterenol induced relaxation in isolated guinea pig tr...

J Med Chem 26: 950-7 (1983)


BindingDB Entry DOI: 10.7270/Q2GH9K4C
More data for this
Ligand-Target Pair
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