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Compile Data Set for Download or QSAR

Found 37 hits of ic50 data for polymerid = 49000244,49000246   
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-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/a 35n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Inhibitory activity against beta-1 adrenergic receptor in guinea pig atria is determined


J Med Chem 36: 3077-86 (1993)

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)

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


(GUINEA PIG)
BDBM50017383
PNG
(9a-Methoxy-5,6,7,8,9,9a-hexahydro-4bH-benzo[a]azul...)
Show SMILES COC12CCCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C22H34N2O3/c1-21(2,3)23-14-16(25)15-27-24-20-18-11-8-7-10-17(18)19-12-6-5-9-13-22(19,20)26-4/h7-8,10-11,16,19,23,25H,5-6,9,12-15H2,1-4H3/b24-20-
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n/an/a 160n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM25756
PNG
((2R,3R)-2,3-dihydroxysuccinic acid;1-(isopropylami...)
Show SMILES COCCc1ccc(OCC(O)CNC(C)C)cc1
Show InChI InChI=1S/C15H25NO3/c1-12(2)16-10-14(17)11-19-15-6-4-13(5-7-15)8-9-18-3/h4-7,12,14,16-17H,8-11H2,1-3H3
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n/an/a 190n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for beta1-adrenergic blocking effect by measuring the ability to inhibit the positive inotropic effect of isoproterenol on the isolated right ...


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


(GUINEA PIG)
BDBM25756
PNG
((2R,3R)-2,3-dihydroxysuccinic acid;1-(isopropylami...)
Show SMILES COCCc1ccc(OCC(O)CNC(C)C)cc1
Show InChI InChI=1S/C15H25NO3/c1-12(2)16-10-14(17)11-19-15-6-4-13(5-7-15)8-9-18-3/h4-7,12,14,16-17H,8-11H2,1-3H3
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n/an/a 320n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for beta2-adrenergic blocking effect by measuring the ability to inhibit the relaxing effect of epinephrine on the isolated tracheal muscle of...


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


(GUINEA PIG)
BDBM50017385
PNG
(9a-Hydroxy-5,6,7,8,9,9a-hexahydro-4bH-benzo[a]azul...)
Show SMILES CC(C)(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCCC12O
Show InChI InChI=1S/C21H32N2O3/c1-20(2,3)22-13-15(24)14-26-23-19-17-10-7-6-9-16(17)18-11-5-4-8-12-21(18,19)25/h6-7,9-10,15,18,22,24-25H,4-5,8,11-14H2,1-3H3/b23-19-
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n/an/a 340n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50017396
PNG
(7-Fluoro-9a-methoxy-1,2,3,4,4a,9a-hexahydro-fluore...)
Show SMILES COC12CCCCC1c1ccc(F)cc1\C2=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C21H31FN2O3/c1-20(2,3)23-12-15(25)13-27-24-19-17-11-14(22)8-9-16(17)18-7-5-6-10-21(18,19)26-4/h8-9,11,15,18,23,25H,5-7,10,12-13H2,1-4H3/b24-19-
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n/an/a 830n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50017390
PNG
(9a-(2-Hydroxy-ethoxy)-1,2,3,4,4a,9a-hexahydro-fluo...)
Show SMILES CC(C)(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCC12OCCO
Show InChI InChI=1S/C22H34N2O4/c1-21(2,3)23-14-16(26)15-28-24-20-18-9-5-4-8-17(18)19-10-6-7-11-22(19,20)27-13-12-25/h4-5,8-9,16,19,23,25-26H,6-7,10-15H2,1-3H3/b24-20-
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n/an/a 850n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50017395
PNG
(9a-Hydroxy-5,6,7,8,9,9a-hexahydro-4bH-benzo[a]azul...)
Show SMILES CC(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCCC12O
Show InChI InChI=1S/C20H30N2O3/c1-14(2)21-12-15(23)13-25-22-19-17-9-6-5-8-16(17)18-10-4-3-7-11-20(18,19)24/h5-6,8-9,14-15,18,21,23-24H,3-4,7,10-13H2,1-2H3/b22-19-
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n/an/a 890n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50017388
PNG
(9a-Methoxy-1,2,3,4,4a,9a-hexahydro-fluoren-9-one O...)
Show SMILES COC12CCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C20H30N2O3/c1-14(2)21-12-15(23)13-25-22-19-17-9-5-4-8-16(17)18-10-6-7-11-20(18,19)24-3/h4-5,8-9,14-15,18,21,23H,6-7,10-13H2,1-3H3/b22-19-
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n/an/a 1.20E+3n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50289372
PNG
((S)-1,1-Difluoro-3-isopropylamino-1-[4-(2-methoxy-...)
Show SMILES COCCc1ccc(OC(F)(F)[C@@H](O)CNC(C)C)cc1
Show InChI InChI=1S/C15H23F2NO3/c1-11(2)18-10-14(19)15(16,17)21-13-6-4-12(5-7-13)8-9-20-3/h4-7,11,14,18-19H,8-10H2,1-3H3/t14-/m0/s1
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n/an/a 1.35E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for beta1-adrenergic blocking effect by measuring the ability to inhibit the positive inotropic effect of isoproterenol on the isolated right ...


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


(GUINEA PIG)
BDBM50289372
PNG
((S)-1,1-Difluoro-3-isopropylamino-1-[4-(2-methoxy-...)
Show SMILES COCCc1ccc(OC(F)(F)[C@@H](O)CNC(C)C)cc1
Show InChI InChI=1S/C15H23F2NO3/c1-11(2)18-10-14(19)15(16,17)21-13-6-4-12(5-7-13)8-9-20-3/h4-7,11,14,18-19H,8-10H2,1-3H3/t14-/m0/s1
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n/an/a 2.15E+3n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Tested for beta2-adrenergic blocking effect by measuring the ability to inhibit the relaxing effect of epinephrine on the isolated tracheal muscle of...


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


(GUINEA PIG)
BDBM50017387
PNG
(9a-Hydroxy-1,2,3,4,4a,9a-hexahydro-fluoren-9-one O...)
Show SMILES CC(C)(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCC12O
Show InChI InChI=1S/C20H30N2O3/c1-19(2,3)21-12-14(23)13-25-22-18-16-9-5-4-8-15(16)17-10-6-7-11-20(17,18)24/h4-5,8-9,14,17,21,23-24H,6-7,10-13H2,1-3H3/b22-18-
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n/an/a 2.80E+3n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50017392
PNG
(9a-Methoxy-5,6,7,8,9,9a-hexahydro-4bH-benzo[a]azul...)
Show SMILES COC12CCCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C21H32N2O3/c1-15(2)22-13-16(24)14-26-23-20-18-10-7-6-9-17(18)19-11-5-4-8-12-21(19,20)25-3/h6-7,9-10,15-16,19,22,24H,4-5,8,11-14H2,1-3H3/b23-20-
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n/an/a 3.00E+3n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50041914
PNG
(1-Aminomethyl-isochroman-6,7-diol | CHEMBL105383)
Show SMILES NCC1OCCc2cc(O)c(O)cc12
Show InChI InChI=1S/C10H13NO3/c11-5-10-7-4-9(13)8(12)3-6(7)1-2-14-10/h3-4,10,12-13H,1-2,5,11H2
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n/an/a 6.76E+3n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Inhibitory activity against beta-1 adrenergic receptor in guinea pig atria is determined


J Med Chem 36: 3077-86 (1993)

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)

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


(GUINEA PIG)
BDBM50017381
PNG
(7-Fluoro-9a-methoxy-1,2,3,4,4a,9a-hexahydro-fluore...)
Show SMILES COc1cc(CCNCC(O)CO\N=C2\c3cc(F)ccc3C3CCCCC23OC)cc(OC)c1
Show InChI InChI=1S/C27H35FN2O5/c1-32-21-12-18(13-22(15-21)33-2)9-11-29-16-20(31)17-35-30-26-24-14-19(28)7-8-23(24)25-6-4-5-10-27(25,26)34-3/h7-8,12-15,20,25,29,31H,4-6,9-11,16-17H2,1-3H3/b30-26-
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n/an/a>1.00E+4n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50017380
PNG
(9a-(2-Hydroxy-ethoxy)-5,6,7,8,9,9a-hexahydro-4bH-b...)
Show SMILES CC(C)(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCCC12OCCO
Show InChI InChI=1S/C23H36N2O4/c1-22(2,3)24-15-17(27)16-29-25-21-19-10-7-6-9-18(19)20-11-5-4-8-12-23(20,21)28-14-13-26/h6-7,9-10,17,20,24,26-27H,4-5,8,11-16H2,1-3H3/b25-21-
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Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50017389
PNG
(13a-Methoxy-5,6,7,8,9,10,11,12,13,13a-decahydro-4b...)
Show SMILES COc1cc(CCNCC(O)CO\N=C2\c3ccccc3C3CCCCCCCCCC23OC)cc(OC)c1
Show InChI InChI=1S/C32H46N2O5/c1-36-26-19-24(20-27(21-26)37-2)16-18-33-22-25(35)23-39-34-31-29-14-11-10-13-28(29)30-15-9-7-5-4-6-8-12-17-32(30,31)38-3/h10-11,13-14,19-21,25,30,33,35H,4-9,12,15-18,22-23H2,1-3H3/b34-31-
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Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50017394
PNG
(9a-Methoxy-1,2,3,4,4a,9a-hexahydro-fluoren-9-one O...)
Show SMILES COc1cc(CCNCC(O)CO\N=C2\c3ccccc3C3CCCCC23OC)cc(OC)c1
Show InChI InChI=1S/C27H36N2O5/c1-31-21-14-19(15-22(16-21)32-2)11-13-28-17-20(30)18-34-29-26-24-9-5-4-8-23(24)25-10-6-7-12-27(25,26)33-3/h4-5,8-9,14-16,20,25,28,30H,6-7,10-13,17-18H2,1-3H3/b29-26-
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Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50017391
PNG
(9a-(2-Hydroxy-ethoxy)-5,6,7,8,9,9a-hexahydro-4bH-b...)
Show SMILES CC(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCCC12OCCO
Show InChI InChI=1S/C22H34N2O4/c1-16(2)23-14-17(26)15-28-24-21-19-9-6-5-8-18(19)20-10-4-3-7-11-22(20,21)27-13-12-25/h5-6,8-9,16-17,20,23,25-26H,3-4,7,10-15H2,1-2H3/b24-21-
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n/an/a>1.00E+4n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50017384
PNG
(9a-Methoxy-1,2,3,4,4a,9a-hexahydro-fluoren-9-one O...)
Show SMILES COC12CCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)(C)C
Show InChI InChI=1S/C21H32N2O3/c1-20(2,3)22-13-15(24)14-26-23-19-17-10-6-5-9-16(17)18-11-7-8-12-21(18,19)25-4/h5-6,9-10,15,18,22,24H,7-8,11-14H2,1-4H3/b23-19-
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n/an/a 1.20E+4n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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)

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


(GUINEA PIG)
BDBM50017379
PNG
(9a-Methoxy-5,6,7,8,9,9a-hexahydro-4bH-benzo[a]azul...)
Show SMILES COc1cc(CCNCC(O)CO\N=C2\c3ccccc3C3CCCCCC23OC)cc(OC)c1
Show InChI InChI=1S/C28H38N2O5/c1-32-22-15-20(16-23(17-22)33-2)12-14-29-18-21(31)19-35-30-27-25-10-7-6-9-24(25)26-11-5-4-8-13-28(26,27)34-3/h6-7,9-10,15-17,21,26,29,31H,4-5,8,11-14,18-19H2,1-3H3/b30-27-
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n/an/a 1.30E+4n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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)

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)

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)

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)

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


(GUINEA PIG)
BDBM50017386
PNG
(7-Fluoro-9a-methoxy-1,2,3,4,4a,9a-hexahydro-fluore...)
Show SMILES COC12CCCCC1c1ccc(F)cc1\C2=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C20H29FN2O3/c1-13(2)22-11-15(24)12-26-23-19-17-10-14(21)7-8-16(17)18-6-4-5-9-20(18,19)25-3/h7-8,10,13,15,18,22,24H,4-6,9,11-12H2,1-3H3/b23-19-
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n/an/a 1.90E+4n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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)

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)

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


(GUINEA PIG)
BDBM50041915
PNG
(1-(Isopropylamino-methyl)-isochroman-6,7-diol | CH...)
Show SMILES CC(C)NCC1OCCc2cc(O)c(O)cc12
Show InChI InChI=1S/C13H19NO3/c1-8(2)14-7-13-10-6-12(16)11(15)5-9(10)3-4-17-13/h5-6,8,13-16H,3-4,7H2,1-2H3
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n/an/a 3.39E+4n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Inhibitory activity against beta-1 adrenergic receptor in guinea pig atria is determined


J Med Chem 36: 3077-86 (1993)

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


(GUINEA PIG)
BDBM50010891
PNG
(1-Aminomethyl-isochroman-5,6-diol | 1-Aminomethyl-...)
Show SMILES NCC1OCCc2c(O)c(O)ccc12
Show InChI InChI=1S/C10H13NO3/c11-5-9-6-1-2-8(12)10(13)7(6)3-4-14-9/h1-2,9,12-13H,3-5,11H2
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n/an/a 6.61E+4n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Inhibitory activity against beta-1 adrenergic receptor in guinea pig atria is determined


J Med Chem 36: 3077-86 (1993)

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


(GUINEA PIG)
BDBM50017378
PNG
(9a-(2-Hydroxy-ethoxy)-1,2,3,4,4a,9a-hexahydro-fluo...)
Show SMILES CC(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCC12OCCO
Show InChI InChI=1S/C21H32N2O4/c1-15(2)22-13-16(25)14-27-23-20-18-8-4-3-7-17(18)19-9-5-6-10-21(19,20)26-12-11-24/h3-4,7-8,15-16,19,22,24-25H,5-6,9-14H2,1-2H3/b23-20-
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n/an/a>1.00E+5n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50017382
PNG
(13a-Methoxy-5,6,7,8,9,10,11,12,13,13a-decahydro-4b...)
Show SMILES COC12CCCCCCCCCC1c1ccccc1\C2=N\OCC(O)CNC(C)C
Show InChI InChI=1S/C25H40N2O3/c1-19(2)26-17-20(28)18-30-27-24-22-14-11-10-13-21(22)23-15-9-7-5-4-6-8-12-16-25(23,24)29-3/h10-11,13-14,19-20,23,26,28H,4-9,12,15-18H2,1-3H3/b27-24-
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n/an/a>1.00E+5n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50017393
PNG
(9a-Hydroxy-1,2,3,4,4a,9a-hexahydro-fluoren-9-one O...)
Show SMILES CC(C)NCC(O)CO\N=C1\c2ccccc2C2CCCCC12O
Show InChI InChI=1S/C19H28N2O3/c1-13(2)20-11-14(22)12-24-21-18-16-8-4-3-7-15(16)17-9-5-6-10-19(17,18)23/h3-4,7-8,13-14,17,20,22-23H,5-6,9-12H2,1-2H3/b21-18-
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n/an/a>1.00E+5n/an/an/an/an/an/a



Université de Nancy I

Curated by ChEMBL


Assay Description
Beta-1 adrenergic receptor blocking was assessed from 50% inhibition of the isoproterenol submaximal response on isolated Guinea pig atria(IA)


J Med Chem 32: 315-20 (1989)

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


(GUINEA PIG)
BDBM50041913
PNG
(1-(Isopropylamino-methyl)-isochroman-5,6-diol | CH...)
Show SMILES CC(C)NCC1OCCc2c(O)c(O)ccc12
Show InChI InChI=1S/C13H19NO3/c1-8(2)14-7-12-9-3-4-11(15)13(16)10(9)5-6-17-12/h3-4,8,12,14-16H,5-7H2,1-2H3
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n/an/a>3.16E+5n/an/an/an/an/an/a



Universit£ di Pisa

Curated by ChEMBL


Assay Description
Inhibitory activity against beta-1 adrenergic receptor in guinea pig atria is determined


J Med Chem 36: 3077-86 (1993)

More data for this
Ligand-Target Pair