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PubMed code 2903245

Compile data set for download or QSAR
Found 47 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


(GUINEA PIG)
BDBM50405637
PNG
(CHEMBL302605)
Show SMILES O[C@H](COCCCc1ccccc1)[C@H]1CCCCN1
Show InChI InChI=1S/C16H25NO2/c18-16(15-10-4-5-11-17-15)13-19-12-6-9-14-7-2-1-3-8-14/h1-3,7-8,15-18H,4-6,9-13H2/t15-,16-/m1/s1
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n/an/an/a 380n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 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 0.151n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50405627
PNG
(CHEMBL68996)
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-/m1/s1
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n/an/an/a>126n/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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50405618
PNG
(CHEMBL66449)
Show SMILES CC(C)NCC(O)COCCCc1ccccc1
Show InChI InChI=1S/C15H25NO2/c1-13(2)16-11-15(17)12-18-10-6-9-14-7-4-3-5-8-14/h3-5,7-8,13,15-17H,6,9-12H2,1-2H3
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n/an/an/a 115n/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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 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 1.70n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50405629
PNG
(CHEMBL302935)
Show SMILES O[C@H](COCc1ccccc1)[C@@H]1CCCCN1
Show InChI InChI=1S/C14H21NO2/c16-14(13-8-4-5-9-15-13)11-17-10-12-6-2-1-3-7-12/h1-3,6-7,13-16H,4-5,8-11H2/t13-,14+/m0/s1
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n/an/an/a 120n/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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50405630
PNG
(CHEMBL66331)
Show SMILES CC(C)NCC(O)COCc1ccccc1
Show InChI InChI=1S/C13H21NO2/c1-11(2)14-8-13(15)10-16-9-12-6-4-3-5-7-12/h3-7,11,13-15H,8-10H2,1-2H3
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n/an/an/a 1.10E+3n/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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50405636
PNG
(CHEMBL66724)
Show SMILES CN1CCCC[C@@H]1[C@H](O)COc1ccccc1
Show InChI InChI=1S/C14H21NO2/c1-15-10-6-5-9-13(15)14(16)11-17-12-7-3-2-4-8-12/h2-4,7-8,13-14,16H,5-6,9-11H2,1H3/t13-,14-/m1/s1
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n/an/an/a 112n/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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50405635
PNG
(CHEMBL66384)
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-/m1/s1
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n/an/an/a 41n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50405627
PNG
(CHEMBL68996)
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-/m1/s1
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n/an/an/a>257n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 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 4n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50405622
PNG
(CHEMBL67631)
Show SMILES Cc1ccc(OC[C@@H](O)[C@@H]2CCCCN2)cc1
Show InChI InChI=1S/C14H21NO2/c1-11-5-7-12(8-6-11)17-10-14(16)13-4-2-3-9-15-13/h5-8,13-16H,2-4,9-10H2,1H3/t13-,14+/m0/s1
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n/an/an/a 58n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50405618
PNG
(CHEMBL66449)
Show SMILES CC(C)NCC(O)COCCCc1ccccc1
Show InChI InChI=1S/C15H25NO2/c1-13(2)16-11-15(17)12-18-10-6-9-14-7-4-3-5-8-14/h3-5,7-8,13,15-17H,6,9-12H2,1-2H3
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n/an/an/a 251n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50405624
PNG
(CHEMBL66324)
Show SMILES O[C@H](COCCCc1ccccc1)[C@@H]1CCCCN1
Show InChI InChI=1S/C16H25NO2/c18-16(15-10-4-5-11-17-15)13-19-12-6-9-14-7-2-1-3-8-14/h1-3,7-8,15-18H,4-6,9-13H2/t15-,16+/m0/s1
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n/an/an/a 275n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50405617
PNG
(CHEMBL66702)
Show SMILES O[C@H](COCc1ccccc1)[C@H]1CCCCN1
Show InChI InChI=1S/C14H21NO2/c16-14(13-8-4-5-9-15-13)11-17-10-12-6-2-1-3-7-12/h1-3,6-7,13-16H,4-5,8-11H2/t13-,14-/m1/s1
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n/an/an/a 33.9n/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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50405622
PNG
(CHEMBL67631)
Show SMILES Cc1ccc(OC[C@@H](O)[C@@H]2CCCCN2)cc1
Show InChI InChI=1S/C14H21NO2/c1-11-5-7-12(8-6-11)17-10-14(16)13-4-2-3-9-15-13/h5-8,13-16H,2-4,9-10H2,1H3/t13-,14+/m0/s1
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n/an/an/a 47.9n/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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 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 8.70n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50405630
PNG
(CHEMBL66331)
Show SMILES CC(C)NCC(O)COCc1ccccc1
Show InChI InChI=1S/C13H21NO2/c1-11(2)14-8-13(15)10-16-9-12-6-4-3-5-7-12/h3-7,11,13-15H,8-10H2,1-2H3
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n/an/an/a 1.05E+3n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50405634
PNG
(CHEMBL66662)
Show SMILES CC(C)N(C)CC(O)COc1ccccc1
Show InChI InChI=1S/C13H21NO2/c1-11(2)14(3)9-12(15)10-16-13-7-5-4-6-8-13/h4-8,11-12,15H,9-10H2,1-3H3
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n/an/an/a 100n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 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 96n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 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 20n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50405623
PNG
(CHEMBL304725)
Show SMILES Cc1ccc(OC[C@@H](O)[C@H]2CCCCN2)cc1
Show InChI InChI=1S/C14H21NO2/c1-11-5-7-12(8-6-11)17-10-14(16)13-4-2-3-9-15-13/h5-8,13-16H,2-4,9-10H2,1H3/t13-,14-/m1/s1
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n/an/an/a>71n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50405635
PNG
(CHEMBL66384)
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-/m1/s1
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n/an/an/a 81.3n/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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 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 2.5n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 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 1.80n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50405636
PNG
(CHEMBL66724)
Show SMILES CN1CCCC[C@@H]1[C@H](O)COc1ccccc1
Show InChI InChI=1S/C14H21NO2/c1-15-10-6-5-9-13(15)14(16)11-17-12-7-3-2-4-8-12/h2-4,7-8,13-14,16H,5-6,9-11H2,1H3/t13-,14-/m1/s1
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n/an/an/a 158n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50405623
PNG
(CHEMBL304725)
Show SMILES Cc1ccc(OC[C@@H](O)[C@H]2CCCCN2)cc1
Show InChI InChI=1S/C14H21NO2/c1-11-5-7-12(8-6-11)17-10-14(16)13-4-2-3-9-15-13/h5-8,13-16H,2-4,9-10H2,1H3/t13-,14-/m1/s1
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n/an/an/a>85.1n/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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50405634
PNG
(CHEMBL66662)
Show SMILES CC(C)N(C)CC(O)COc1ccccc1
Show InChI InChI=1S/C13H21NO2/c1-11(2)14(3)9-12(15)10-16-13-7-5-4-6-8-13/h4-8,11-12,15H,9-10H2,1-3H3
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n/an/an/a 224n/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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 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 1.80n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 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>7.90n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50405620
PNG
(CHEMBL67331)
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-/m1/s1
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n/an/an/a>102n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50405629
PNG
(CHEMBL302935)
Show SMILES O[C@H](COCc1ccccc1)[C@@H]1CCCCN1
Show InChI InChI=1S/C14H21NO2/c16-14(13-8-4-5-9-15-13)11-17-10-12-6-2-1-3-7-12/h1-3,6-7,13-16H,4-5,8-11H2/t13-,14+/m0/s1
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n/an/an/a 49n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50405617
PNG
(CHEMBL66702)
Show SMILES O[C@H](COCc1ccccc1)[C@H]1CCCCN1
Show InChI InChI=1S/C14H21NO2/c16-14(13-8-4-5-9-15-13)11-17-10-12-6-2-1-3-7-12/h1-3,6-7,13-16H,4-5,8-11H2/t13-,14-/m1/s1
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n/an/an/a 81n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50405624
PNG
(CHEMBL66324)
Show SMILES O[C@H](COCCCc1ccccc1)[C@@H]1CCCCN1
Show InChI InChI=1S/C16H25NO2/c18-16(15-10-4-5-11-17-15)13-19-12-6-9-14-7-2-1-3-8-14/h1-3,7-8,15-18H,4-6,9-13H2/t15-,16+/m0/s1
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n/an/an/a 25.1n/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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50405620
PNG
(CHEMBL67331)
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-/m1/s1
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n/an/an/a>75.9n/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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(GUINEA PIG)
BDBM50405631
PNG
(CHEMBL63582)
Show SMILES CN1CCCC[C@H]1[C@H](O)COc1ccccc1
Show InChI InChI=1S/C14H21NO2/c1-15-10-6-5-9-13(15)14(16)11-17-12-7-3-2-4-8-12/h2-4,7-8,13-14,16H,5-6,9-11H2,1H3/t13-,14+/m0/s1
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n/an/an/a 79.4n/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)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50405631
PNG
(CHEMBL63582)
Show SMILES CN1CCCC[C@H]1[C@H](O)COc1ccccc1
Show InChI InChI=1S/C14H21NO2/c1-15-10-6-5-9-13(15)14(16)11-17-12-7-3-2-4-8-12/h2-4,7-8,13-14,16H,5-6,9-11H2,1H3/t13-,14+/m0/s1
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n/an/an/a 56n/an/an/an/an/a



Universidad de Barcelona

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor activitation measured by isoprenaline-induced positive inotropic effect in guinea pig left atrium


J Med Chem 31: 2122-6 (1988)


Article DOI: 10.1021/jm00119a011
BindingDB Entry DOI: 10.7270/Q2J67J4Q
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%