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Compile Data Set for Download or QSAR

Found 259 hits of kd data for polymerid = 49000249,49000250,49000251   
Target
(Institution)
LigandTarget
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)
BDBM50405625
PNG
(CHEMBL304344)
Show SMILES O[C@H](COc1cccc2ccccc12)[C@@H]1CCCCN1
Show InChI InChI=1S/C17H21NO2/c19-16(15-9-3-4-11-18-15)12-20-17-10-5-7-13-6-1-2-8-14(13)17/h1-2,5-8,10,15-16,18-19H,3-4,9,11-12H2/t15-,16+/m0/s1
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n/an/an/a 0.0631n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Antagonism of isoprenaline-induced relaxation of guinea pig tracheal chains, contracted with carbachol


J Med Chem 31: 2122-6 (1988)

More data for this
Ligand-Target Pair
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
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 0.166n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against beta-2 adrenoceptor was measured by the inhibition of isoproterenol-induced relaxation of PGF2-alpha contracted ...


J Med Chem 29: 1065-80 (1986)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
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
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
Beta-2 adrenergic receptor antagonistic activity on guinea pig tracheal chains


J Med Chem 25: 931-6 (1982)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
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
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)

More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
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
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...


Citation and Details
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 0.977n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against beta-2 adrenergic receptor was measured by the inhibition of isoproterenol-induced relaxation of PGF2-alpha cont...


J Med Chem 29: 1065-80 (1986)

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


(GUINEA PIG)
BDBM50405626
PNG
(CHEMBL69635)
Show SMILES O[C@H](COc1cccc2ccccc12)[C@H]1CCCCN1
Show InChI InChI=1S/C17H21NO2/c19-16(15-9-3-4-11-18-15)12-20-17-10-5-7-13-6-1-2-8-14(13)17/h1-2,5-8,10,15-16,18-19H,3-4,9,11-12H2/t15-,16-/m1/s1
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n/an/an/a 1.23n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Antagonism of isoprenaline-induced relaxation of guinea pig tracheal chains, contracted with carbachol


J Med Chem 31: 2122-6 (1988)

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)

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)

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)

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)

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)

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


(GUINEA PIG)
BDBM50405013
PNG
(CHEMBL285972)
Show SMILES CC(C)(C)NCC(O)CON=C(C1CC1)C1CC1
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
In vitro inhibitory activity against beta-2 adrenergic receptor determined as pA2 in guinea pig trachea


J Med Chem 28: 896-900 (1985)

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


(GUINEA PIG)
BDBM50405013
PNG
(CHEMBL285972)
Show SMILES CC(C)(C)NCC(O)CON=C(C1CC1)C1CC1
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)

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


(GUINEA PIG)
BDBM50405239
PNG
(CHEMBL287766)
Show SMILES CCCC(CCC)=NOCC(O)CNC(C)(C)C
Show InChI InChI=1S/C14H30N2O2/c1-6-8-12(9-7-2)16-18-11-13(17)10-15-14(3,4)5/h13,15,17H,6-11H2,1-5H3
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n/an/an/a 2.40n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonistic activity against beta-2 adrenergic receptor on isolated guinea pig tracheal strips


J Med Chem 28: 153-60 (1985)

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)

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


(GUINEA PIG)
BDBM50405236
PNG
(CHEMBL41839)
Show SMILES CC(C)NCC(O)CON=C(C(C)C)C(C)C
Show InChI InChI=1S/C13H28N2O2/c1-9(2)13(10(3)4)15-17-8-12(16)7-14-11(5)6/h9-12,14,16H,7-8H2,1-6H3
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n/an/an/a 3.02n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonistic activity against beta-2 adrenergic receptor on isolated guinea pig tracheal strips


J Med Chem 28: 153-60 (1985)

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)

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



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Antagonism of isoprenaline-induced relaxation of guinea pig tracheal chains, contracted with carbachol


J Med Chem 31: 2122-6 (1988)

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


(GUINEA PIG)
BDBM50405619
PNG
(CHEMBL419994)
Show SMILES Cc1cccc(OC[C@@H](O)[C@@H]2CCCCN2)c1
Show InChI InChI=1S/C14H21NO2/c1-11-5-4-6-12(9-11)17-10-14(16)13-7-2-3-8-15-13/h4-6,9,13-16H,2-3,7-8,10H2,1H3/t13-,14+/m0/s1
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n/an/an/a 3.39n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Antagonism of isoprenaline-induced relaxation of guinea pig tracheal chains, contracted with carbachol


J Med Chem 31: 2122-6 (1988)

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)

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
In vitro inhibitory activity against beta-2 adrenergic receptor determined as pA2 in guinea pig trachea


J Med Chem 28: 896-900 (1985)

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


(GUINEA PIG)
BDBM50405237
PNG
(CHEMBL40626)
Show SMILES CCC(CC)=NOCC(O)CNC(C)C
Show InChI InChI=1S/C11H24N2O2/c1-5-10(6-2)13-15-8-11(14)7-12-9(3)4/h9,11-12,14H,5-8H2,1-4H3
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n/an/an/a 4.17n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonistic activity against beta-2 adrenergic receptor on isolated guinea pig tracheal strips


J Med Chem 28: 153-60 (1985)

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
Show InChI InChI=1/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?/s2
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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


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


(GUINEA PIG)
BDBM50405234
PNG
(CHEMBL40783)
Show SMILES CCCC(CCC)=NOCC(O)CNC(C)C
Show InChI InChI=1S/C13H28N2O2/c1-5-7-12(8-6-2)15-17-10-13(16)9-14-11(3)4/h11,13-14,16H,5-10H2,1-4H3
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n/an/an/a 6.31n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonistic activity against beta-2 adrenergic receptor on isolated guinea pig tracheal strips


J Med Chem 28: 153-60 (1985)

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)

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


(GUINEA PIG)
BDBM50405278
PNG
(FALINTOLOL)
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 6.90n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against beta-2 adrenergic receptor determined as pA2 in guinea pig trachea


J Med Chem 28: 896-900 (1985)

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


(GUINEA PIG)
BDBM50405278
PNG
(FALINTOLOL)
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 6.92n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against beta-2 adrenergic receptor determined as pA2 in guinea pig trachea


J Med Chem 28: 896-900 (1985)

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


(GUINEA PIG)
BDBM50405633
PNG
(CHEMBL67151)
Show SMILES CC(C)NCC(O)COc1ccc(C)cc1
Show InChI InChI=1S/C13H21NO2/c1-10(2)14-8-12(15)9-16-13-6-4-11(3)5-7-13/h4-7,10,12,14-15H,8-9H2,1-3H3
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n/an/an/a 7.08n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Antagonism of isoprenaline-induced relaxation of guinea pig tracheal chains, contracted with carbachol


J Med Chem 31: 2122-6 (1988)

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)

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)

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


(GUINEA PIG)
BDBM50405277
PNG
(CHEMBL1788274)
Show SMILES CC(C)(C)NC[C@@H](O)CON=C(C1CC1)C1CC1
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/t12-/m1/s1
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n/an/an/a 8.91n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against beta-2 adrenergic receptor determined as pA2 in guinea pig trachea


J Med Chem 28: 896-900 (1985)

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
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)

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)

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


(GUINEA PIG)
BDBM50405281
PNG
(CHEMBL355100)
Show SMILES C\C(=N/OC[C@@H](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+/t11-/m0/s1
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n/an/an/a 9.77n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against beta-2 adrenergic receptor determined as pA2 in guinea pig trachea


J Med Chem 28: 896-900 (1985)

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


(GUINEA PIG)
BDBM50405240
PNG
(CHEMBL289858)
Show SMILES CCC(CC)=NOCC(O)CNC(C)(C)C
Show InChI InChI=1S/C12H26N2O2/c1-6-10(7-2)14-16-9-11(15)8-13-12(3,4)5/h11,13,15H,6-9H2,1-5H3
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n/an/an/a 10.5n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Antagonistic activity against beta-2 adrenergic receptor on isolated guinea pig tracheal strips


J Med Chem 28: 153-60 (1985)

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


(GUINEA PIG)
BDBM50241366
PNG
((S)-1-(isopropylamino)-3-(m-tolyloxy)propan-2-ol |...)
Show SMILES CC(C)NC[C@H](O)COc1cccc(C)c1
Show InChI InChI=1S/C13H21NO2/c1-10(2)14-8-12(15)9-16-13-6-4-5-11(3)7-13/h4-7,10,12,14-15H,8-9H2,1-3H3/t12-/m0/s1
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n/an/an/a 11.5n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Antagonism of isoprenaline-induced relaxation of guinea pig tracheal chains, contracted with carbachol


J Med Chem 31: 2122-6 (1988)

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)

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)

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)

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


(GUINEA PIG)
BDBM50405282
PNG
(CHEMBL2093060)
Show SMILES CC(C)(C)NC[C@H](O)CON=C(C1CC1)C1CC1
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/t12-/m0/s1
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n/an/an/a 12.6n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro inhibitory activity against beta-2 adrenergic receptor determined as pA2 in guinea pig trachea


J Med Chem 28: 896-900 (1985)

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


(GUINEA PIG)
BDBM50405278
PNG
(FALINTOLOL)
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



Institut de Pharmacologie (UA 589 CNRS)

Curated by ChEMBL


Assay Description
The compound was tested for beta-adrenergic activity against Beta-2 adrenergic receptor from guinea pig trachea.


J Med Chem 34: 3197-204 (1991)

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


(GUINEA PIG)
BDBM50405621
PNG
(CHEMBL68945)
Show SMILES O[C@H](COc1ccccc1)[C@@H]1CCCCN1
Show InChI InChI=1S/C13H19NO2/c15-13(12-8-4-5-9-14-12)10-16-11-6-2-1-3-7-11/h1-3,6-7,12-15H,4-5,8-10H2/t12-,13+/m0/s1
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n/an/an/a 13.8n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Antagonism of isoprenaline-induced relaxation of guinea pig tracheal chains, contracted with carbachol


J Med Chem 31: 2122-6 (1988)

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


(GUINEA PIG)
BDBM50169785
PNG
((2-Hydroxy-3-phenoxy-propyl)-isopropyl-ammonium | ...)
Show SMILES CC(C)NCC(O)COc1ccccc1
Show InChI InChI=1S/C12H19NO2/c1-10(2)13-8-11(14)9-15-12-6-4-3-5-7-12/h3-7,10-11,13-14H,8-9H2,1-2H3
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n/an/an/a 13.8n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Antagonism of isoprenaline-induced relaxation of guinea pig tracheal chains, contracted with carbachol


J Med Chem 31: 2122-6 (1988)

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


(GUINEA PIG)
BDBM50404945
PNG
(CHEMBL1744069)
Show SMILES CC(C)(C)NC[C@@H](O)COc1nsnc1N1CCOCC1
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-/m1/s1
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n/an/an/a 13.8n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor antagonistic activity on guinea pig tracheal chains


J Med Chem 25: 931-6 (1982)

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


(GUINEA PIG)
BDBM50405628
PNG
(CHEMBL302339)
Show SMILES O[C@H](COc1ccc2ccccc2c1)[C@@H]1CCCCN1
Show InChI InChI=1S/C17H21NO2/c19-17(16-7-3-4-10-18-16)12-20-15-9-8-13-5-1-2-6-14(13)11-15/h1-2,5-6,8-9,11,16-19H,3-4,7,10,12H2/t16-,17+/m0/s1
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n/an/an/a 15.5n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Antagonism of isoprenaline-induced relaxation of guinea pig tracheal chains, contracted with carbachol


J Med Chem 31: 2122-6 (1988)

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)

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)

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


(GUINEA PIG)
BDBM50405632
PNG
(CHEMBL68419)
Show SMILES CC(C)NCC(O)COc1ccc2ccccc2c1
Show InChI InChI=1S/C16H21NO2/c1-12(2)17-10-15(18)11-19-16-8-7-13-5-3-4-6-14(13)9-16/h3-9,12,15,17-18H,10-11H2,1-2H3
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n/an/an/a 16.6n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Antagonism of isoprenaline-induced relaxation of guinea pig tracheal chains, contracted with carbachol


J Med Chem 31: 2122-6 (1988)

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


(GUINEA PIG)
BDBM50367111
PNG
(CHEMBL305153)
Show SMILES CC(C)(C)NC[C@H](O)CON=C1c2ccccc2-c2ccccc12
Show InChI InChI=1S/C20H24N2O2/c1-20(2,3)21-12-14(23)13-24-22-19-17-10-6-4-8-15(17)16-9-5-7-11-18(16)19/h4-11,14,21,23H,12-13H2,1-3H3/t14-/m0/s1
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n/an/an/a 17.0n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Beta-2 adrenergic receptor antagonistic activity on guinea pig tracheal chains


J Med Chem 25: 931-6 (1982)

More data for this
Ligand-Target Pair
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