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Compile Data Set for Download or QSAR

Found 85 hits of affinity data for UniProtKB/TrEMBL: P34971   
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


(Mus musculus)
BDBM50027663
PNG
(1-(9H-Carbazol-4-yloxy)-3-isopropylamino-propan-2-...)
Show SMILES CC(C)NCC(O)COc1cccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C18H22N2O2/c1-12(2)19-10-13(21)11-22-17-9-5-8-16-18(17)14-6-3-4-7-15(14)20-16/h3-9,12-13,19-21H,10-11H2,1-2H3
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0.0900n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50167072
PNG
(CHEMBL3799125)
Show SMILES COc1ccccc1OCCNC[C@H](O)COc1cccc2[nH]c3ccccc3c12 |r|
Show InChI InChI=1S/C24H26N2O4/c1-28-21-10-4-5-11-22(21)29-14-13-25-15-17(27)16-30-23-12-6-9-20-24(23)18-7-2-3-8-19(18)26-20/h2-12,17,25-27H,13-16H2,1H3/t17-/m0/s1
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0.210n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50526681
PNG
(CHEMBL4537221)
Show SMILES COc1cc(CCNC[C@H](O)COc2cccc3ccccc23)ccc1OCCSSCCN |r|
Show InChI InChI=1S/C26H34N2O4S2/c1-30-26-17-20(9-10-25(26)31-14-16-34-33-15-12-27)11-13-28-18-22(29)19-32-24-8-4-6-21-5-2-3-7-23(21)24/h2-10,17,22,28-29H,11-16,18-19,27H2,1H3/t22-/m0/s1
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0.490n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50526679
PNG
(CHEMBL4456301)
Show SMILES COc1cc(CCNC[C@H](O)COc2cccc3ccccc23)ccc1OCCCSSCCN |r|
Show InChI InChI=1S/C27H36N2O4S2/c1-31-27-18-21(10-11-26(27)32-15-5-16-34-35-17-13-28)12-14-29-19-23(30)20-33-25-9-4-7-22-6-2-3-8-24(22)25/h2-4,6-11,18,23,29-30H,5,12-17,19-20,28H2,1H3/t23-/m0/s1
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1.10n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM25746
PNG
(2-hydroxy-5-{2-[(2-hydroxy-3-{4-[1-methyl-4-(trifl...)
Show SMILES Cn1cc(nc1-c1ccc(OCC(O)CNCCOc2ccc(O)c(c2)C(N)=O)cc1)C(F)(F)F
Show InChI InChI=1S/C23H25F3N4O5/c1-30-12-20(23(24,25)26)29-22(30)14-2-4-16(5-3-14)35-13-15(31)11-28-8-9-34-17-6-7-19(32)18(10-17)21(27)33/h2-7,10,12,15,28,31-32H,8-9,11,13H2,1H3,(H2,27,33)
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1.40n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
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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2.40n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50526684
PNG
(CHEMBL4437569)
Show SMILES COc1cc(CCNC[C@H](O)COc2ccc(COCCOC(C)C)cc2)ccc1OCCSSCCN |r|
Show InChI InChI=1S/C28H44N2O6S2/c1-22(2)34-14-13-33-20-24-4-7-26(8-5-24)36-21-25(31)19-30-12-10-23-6-9-27(28(18-23)32-3)35-15-17-38-37-16-11-29/h4-9,18,22,25,30-31H,10-17,19-21,29H2,1-3H3/t25-/m0/s1
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2.60n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50167073
PNG
(CHEMBL3798017)
Show SMILES COc1ccccc1OCCNC[C@@H](O)COc1cccc2[nH]c3ccccc3c12 |r|
Show InChI InChI=1S/C24H26N2O4/c1-28-21-10-4-5-11-22(21)29-14-13-25-15-17(27)16-30-23-12-6-9-20-24(23)18-7-2-3-8-19(18)26-20/h2-12,17,25-27H,13-16H2,1H3/t17-/m1/s1
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3.40n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50166979
PNG
(CHEMBL3798748)
Show SMILES COc1cc(CCNC[C@H](O)c2ccc(O)c3NC(=O)COc23)ccc1OCCCc1ccccc1 |r|
Show InChI InChI=1S/C28H32N2O6/c1-34-25-16-20(9-12-24(25)35-15-5-8-19-6-3-2-4-7-19)13-14-29-17-23(32)21-10-11-22(31)27-28(21)36-18-26(33)30-27/h2-4,6-7,9-12,16,23,29,31-32H,5,8,13-15,17-18H2,1H3,(H,30,33)/t23-/m0/s1
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5.10n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 receptor expressed in HEK293 cells


Bioorg Med Chem 24: 2641-53 (2016)


Article DOI: 10.1016/j.bmc.2016.04.028
BindingDB Entry DOI: 10.7270/Q2ZC84S3
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM25751
PNG
(Bisoprolol | Bisoprolol fumarate | Concor | [2-hyd...)
Show SMILES CC(C)NCC(O)COc1ccc(COCCOC(C)C)cc1
Show InChI InChI=1S/C18H31NO4/c1-14(2)19-11-17(20)13-23-18-7-5-16(6-8-18)12-21-9-10-22-15(3)4/h5-8,14-15,17,19-20H,9-13H2,1-4H3
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5.30n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50167066
PNG
(CHEMBL3800400)
Show SMILES COc1cc(CCNC[C@H](O)c2ccc(O)c3[nH]c(=O)ccc23)ccc1OCCCc1ccccc1 |r|
Show InChI InChI=1S/C29H32N2O5/c1-35-27-18-21(9-13-26(27)36-17-5-8-20-6-3-2-4-7-20)15-16-30-19-25(33)22-10-12-24(32)29-23(22)11-14-28(34)31-29/h2-4,6-7,9-14,18,25,30,32-33H,5,8,15-17,19H2,1H3,(H,31,34)/t25-/m0/s1
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5.80n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 receptor expressed in HEK293 cells


Bioorg Med Chem 24: 2641-53 (2016)


Article DOI: 10.1016/j.bmc.2016.04.028
BindingDB Entry DOI: 10.7270/Q2ZC84S3
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50525097
PNG
(CHEMBL4593181)
Show SMILES COc1cc(CCNC[C@H](O)COc2ccc(O)c(O)c2)ccc1OCCCc1ccccc1 |r|
Show InChI InChI=1S/C27H33NO6/c1-32-27-16-21(9-12-26(27)33-15-5-8-20-6-3-2-4-7-20)13-14-28-18-22(29)19-34-23-10-11-24(30)25(31)17-23/h2-4,6-7,9-12,16-17,22,28-31H,5,8,13-15,18-19H2,1H3/t22-/m0/s1
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6.5n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50525100
PNG
(CHEMBL4451135)
Show SMILES COc1ccccc1OCCNC[C@H](O)c1cccc2[nH]c3ccccc3c12 |r|
Show InChI InChI=1S/C23H24N2O3/c1-27-21-11-4-5-12-22(21)28-14-13-24-15-20(26)17-8-6-10-19-23(17)16-7-2-3-9-18(16)25-19/h2-12,20,24-26H,13-15H2,1H3/t20-/m0/s1
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6.60n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50525095
PNG
(CHEMBL4435895)
Show SMILES COc1ccccc1OCCNC[C@H](O)COc1ccc(O)c(O)c1 |r|
Show InChI InChI=1S/C18H23NO6/c1-23-17-4-2-3-5-18(17)24-9-8-19-11-13(20)12-25-14-6-7-15(21)16(22)10-14/h2-7,10,13,19-22H,8-9,11-12H2,1H3/t13-/m0/s1
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12n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50525098
PNG
(CHEMBL1160694)
Show SMILES [H][C@](O)(CNC(C)C)COc1ccc(O)c(O)c1 |r|
Show InChI InChI=1S/C12H19NO4/c1-8(2)13-6-9(14)7-17-10-3-4-11(15)12(16)5-10/h3-5,8-9,13-16H,6-7H2,1-2H3/t9-/m0/s1
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14n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50526685
PNG
(CHEMBL4566666)
Show SMILES COCCc1ccc(OC[C@@H](O)CNCCc2ccc(OCCCSSCCN)c(OC)c2)cc1 |r|
Show InChI InChI=1S/C26H40N2O5S2/c1-30-15-11-21-4-7-24(8-5-21)33-20-23(29)19-28-13-10-22-6-9-25(26(18-22)31-2)32-14-3-16-34-35-17-12-27/h4-9,18,23,28-29H,3,10-17,19-20,27H2,1-2H3/t23-/m0/s1
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22n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50525101
PNG
(CHEMBL4513932)
Show SMILES COc1ccccc1OCCNCCCOc1cccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C24H26N2O3/c1-27-21-11-4-5-12-22(21)29-17-15-25-14-7-16-28-23-13-6-10-20-24(23)18-8-2-3-9-19(18)26-20/h2-6,8-13,25-26H,7,14-17H2,1H3
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24n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50526690
PNG
(CHEMBL4553747)
Show SMILES COCCc1ccc(OC[C@@H](O)CNCCc2ccc(OCCSSCCN)c(OC)c2)cc1 |r|
Show InChI InChI=1S/C25H38N2O5S2/c1-29-13-10-20-3-6-23(7-4-20)32-19-22(28)18-27-12-9-21-5-8-24(25(17-21)30-2)31-14-16-34-33-15-11-26/h3-8,17,22,27-28H,9-16,18-19,26H2,1-2H3/t22-/m0/s1
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27n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50526686
PNG
(CHEMBL4463246)
Show SMILES COc1cc(CCNC[C@@H](O)COc2cccc3ccccc23)ccc1OCCSSCCN |r|
Show InChI InChI=1S/C26H34N2O4S2/c1-30-26-17-20(9-10-25(26)31-14-16-34-33-15-12-27)11-13-28-18-22(29)19-32-24-8-4-6-21-5-2-3-7-23(21)24/h2-10,17,22,28-29H,11-16,18-19,27H2,1H3/t22-/m1/s1
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29n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50526680
PNG
(CHEMBL4463925)
Show SMILES COc1cc(CCNC[C@@H](O)COc2cccc3ccccc23)ccc1OCCCSSCCN |r|
Show InChI InChI=1S/C27H36N2O4S2/c1-31-27-18-21(10-11-26(27)32-15-5-16-34-35-17-13-28)12-14-29-19-23(30)20-33-25-9-4-7-22-6-2-3-8-24(22)25/h2-4,6-11,18,23,29-30H,5,12-17,19-20,28H2,1H3/t23-/m1/s1
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33n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
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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49n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50526682
PNG
(CHEMBL4443911)
Show SMILES Cn1cc(nc1-c1ccc(OC[C@@H](O)CNCCOc2ccc(OCCSSCCN)c(c2)C(N)=O)cc1)C(F)(F)F |r|
Show InChI InChI=1S/C27H34F3N5O5S2/c1-35-16-24(27(28,29)30)34-26(35)18-2-4-20(5-3-18)40-17-19(36)15-33-9-10-38-21-6-7-23(22(14-21)25(32)37)39-11-13-42-41-12-8-31/h2-7,14,16,19,33,36H,8-13,15,17,31H2,1H3,(H2,32,37)/t19-/m0/s1
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49n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50526687
PNG
(CHEMBL4576034)
Show SMILES Cn1cc(nc1-c1ccc(OC[C@@H](O)CNCCOc2ccc(OCCCSSCCN)c(c2)C(N)=O)cc1)C(F)(F)F |r|
Show InChI InChI=1S/C28H36F3N5O5S2/c1-36-17-25(28(29,30)31)35-27(36)19-3-5-21(6-4-19)41-18-20(37)16-34-10-12-39-22-7-8-24(23(15-22)26(33)38)40-11-2-13-42-43-14-9-32/h3-8,15,17,20,34,37H,2,9-14,16,18,32H2,1H3,(H2,33,38)/t20-/m0/s1
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71n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50167063
PNG
(CHEMBL3800341)
Show SMILES COc1cc(CCNCCc2ccc(O)c3NC(=O)COc23)ccc1OCCCc1ccccc1
Show InChI InChI=1S/C28H32N2O5/c1-33-25-18-21(9-12-24(25)34-17-5-8-20-6-3-2-4-7-20)13-15-29-16-14-22-10-11-23(31)27-28(22)35-19-26(32)30-27/h2-4,6-7,9-12,18,29,31H,5,8,13-17,19H2,1H3,(H,30,32)
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79n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 receptor expressed in HEK293 cells


Bioorg Med Chem 24: 2641-53 (2016)


Article DOI: 10.1016/j.bmc.2016.04.028
BindingDB Entry DOI: 10.7270/Q2ZC84S3
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50166977
PNG
(CHEMBL3800303)
Show SMILES COc1cc(CCNC[C@H](O)c2ccc(O)c(O)c2)ccc1OCCCc1ccccc1 |r|
Show InChI InChI=1S/C26H31NO5/c1-31-26-16-20(9-12-25(26)32-15-5-8-19-6-3-2-4-7-19)13-14-27-18-24(30)21-10-11-22(28)23(29)17-21/h2-4,6-7,9-12,16-17,24,27-30H,5,8,13-15,18H2,1H3/t24-/m0/s1
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85n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50166977
PNG
(CHEMBL3800303)
Show SMILES COc1cc(CCNC[C@H](O)c2ccc(O)c(O)c2)ccc1OCCCc1ccccc1 |r|
Show InChI InChI=1S/C26H31NO5/c1-31-26-16-20(9-12-25(26)32-15-5-8-19-6-3-2-4-7-19)13-14-27-18-24(30)21-10-11-22(28)23(29)17-21/h2-4,6-7,9-12,16-17,24,27-30H,5,8,13-15,18H2,1H3/t24-/m0/s1
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85n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 receptor expressed in HEK293 cells


Bioorg Med Chem 24: 2641-53 (2016)


Article DOI: 10.1016/j.bmc.2016.04.028
BindingDB Entry DOI: 10.7270/Q2ZC84S3
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50166976
PNG
(CHEMBL3799455)
Show SMILES COc1cc(CCNCCc2ccc(O)c3[nH]c(=O)ccc23)ccc1OCCCc1ccccc1
Show InChI InChI=1S/C29H32N2O4/c1-34-27-20-22(9-13-26(27)35-19-5-8-21-6-3-2-4-7-21)15-17-30-18-16-23-10-12-25(32)29-24(23)11-14-28(33)31-29/h2-4,6-7,9-14,20,30,32H,5,8,15-19H2,1H3,(H,31,33)
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150n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 receptor expressed in HEK293 cells


Bioorg Med Chem 24: 2641-53 (2016)


Article DOI: 10.1016/j.bmc.2016.04.028
BindingDB Entry DOI: 10.7270/Q2ZC84S3
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50526683
PNG
(CHEMBL4450085)
Show SMILES COc1cc(CCNC[C@H](O)COc2ccc(cc2)-c2nc(cn2C)C(F)(F)F)ccc1OCCSSCCN |r|
Show InChI InChI=1S/C27H35F3N4O4S2/c1-34-17-25(27(28,29)30)33-26(34)20-4-6-22(7-5-20)38-18-21(35)16-32-11-9-19-3-8-23(24(15-19)36-2)37-12-14-40-39-13-10-31/h3-8,15,17,21,32,35H,9-14,16,18,31H2,1-2H3/t21-/m0/s1
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150n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50167064
PNG
(CHEMBL3797876)
Show SMILES COc1ccccc1OCCNC[C@H](O)c1ccc(O)c(O)c1 |r|
Show InChI InChI=1S/C17H21NO5/c1-22-16-4-2-3-5-17(16)23-9-8-18-11-15(21)12-6-7-13(19)14(20)10-12/h2-7,10,15,18-21H,8-9,11H2,1H3/t15-/m0/s1
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160n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 receptor expressed in HEK293 cells


Bioorg Med Chem 24: 2641-53 (2016)


Article DOI: 10.1016/j.bmc.2016.04.028
BindingDB Entry DOI: 10.7270/Q2ZC84S3
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50167064
PNG
(CHEMBL3797876)
Show SMILES COc1ccccc1OCCNC[C@H](O)c1ccc(O)c(O)c1 |r|
Show InChI InChI=1S/C17H21NO5/c1-22-16-4-2-3-5-17(16)23-9-8-18-11-15(21)12-6-7-13(19)14(20)10-12/h2-7,10,15,18-21H,8-9,11H2,1H3/t15-/m0/s1
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160n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50166980
PNG
(CHEMBL3797205)
Show SMILES COc1cc(CCNC[C@@H](O)c2ccc(O)c3NC(=O)COc23)ccc1OCCCc1ccccc1 |r|
Show InChI InChI=1S/C28H32N2O6/c1-34-25-16-20(9-12-24(25)35-15-5-8-19-6-3-2-4-7-19)13-14-29-17-23(32)21-10-11-22(31)27-28(21)36-18-26(33)30-27/h2-4,6-7,9-12,16,23,29,31-32H,5,8,13-15,17-18H2,1H3,(H,30,33)/t23-/m1/s1
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180n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 receptor expressed in HEK293 cells


Bioorg Med Chem 24: 2641-53 (2016)


Article DOI: 10.1016/j.bmc.2016.04.028
BindingDB Entry DOI: 10.7270/Q2ZC84S3
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
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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220n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 receptor expressed in HEK293 cells


Bioorg Med Chem 24: 2641-53 (2016)


Article DOI: 10.1016/j.bmc.2016.04.028
BindingDB Entry DOI: 10.7270/Q2ZC84S3
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50407517
PNG
((-)ISOPROTERENOL | CHEMBL1160723 | US9492405, 27)
Show SMILES CC(C)NC[C@H](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/t11-/m0/s1
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220n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50526688
PNG
(CHEMBL4473272)
Show SMILES COCCc1ccc(OC[C@H](O)CNCCc2ccc(OCCCSSCCN)c(OC)c2)cc1 |r|
Show InChI InChI=1S/C26H40N2O5S2/c1-30-15-11-21-4-7-24(8-5-21)33-20-23(29)19-28-13-10-22-6-9-25(26(18-22)31-2)32-14-3-16-34-35-17-12-27/h4-9,18,23,28-29H,3,10-17,19-20,27H2,1-2H3/t23-/m1/s1
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220n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50167067
PNG
(CHEMBL3800468)
Show SMILES COc1cc(CCNC[C@@H](O)c2ccc(O)c3[nH]c(=O)ccc23)ccc1OCCCc1ccccc1 |r|
Show InChI InChI=1S/C29H32N2O5/c1-35-27-18-21(9-13-26(27)36-17-5-8-20-6-3-2-4-7-20)15-16-30-19-25(33)22-10-12-24(32)29-23(22)11-14-28(34)31-29/h2-4,6-7,9-14,18,25,30,32-33H,5,8,15-17,19H2,1H3,(H,31,34)/t25-/m1/s1
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300n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 receptor expressed in HEK293 cells


Bioorg Med Chem 24: 2641-53 (2016)


Article DOI: 10.1016/j.bmc.2016.04.028
BindingDB Entry DOI: 10.7270/Q2ZC84S3
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50525106
PNG
(CHEMBL4470694)
Show SMILES COc1cc(CCNC[C@@H](O)COc2ccc(O)c(O)c2)ccc1OCCCc1ccccc1 |r|
Show InChI InChI=1S/C27H33NO6/c1-32-27-16-21(9-12-26(27)33-15-5-8-20-6-3-2-4-7-20)13-14-28-18-22(29)19-34-23-10-11-24(30)25(31)17-23/h2-4,6-7,9-12,16-17,22,28-31H,5,8,13-15,18-19H2,1H3/t22-/m1/s1
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310n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50525105
PNG
(CHEMBL4436343)
Show SMILES COc1ccccc1OCCNCCc1cccc2[nH]c3ccccc3c12
Show InChI InChI=1S/C23H24N2O2/c1-26-21-11-4-5-12-22(21)27-16-15-24-14-13-17-7-6-10-20-23(17)18-8-2-3-9-19(18)25-20/h2-12,24-25H,13-16H2,1H3
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330n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50525096
PNG
(CHEMBL4450756)
Show SMILES COc1ccccc1OCCNC[C@@H](O)c1cccc2[nH]c3ccccc3c12 |r|
Show InChI InChI=1S/C23H24N2O3/c1-27-21-11-4-5-12-22(21)28-14-13-24-15-20(26)17-8-6-10-19-23(17)16-7-2-3-9-18(16)25-19/h2-12,20,24-26H,13-15H2,1H3/t20-/m1/s1
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340n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50167068
PNG
(CHEMBL3799427)
Show SMILES COc1cc(CCNC[C@@H](O)c2ccc(O)c(O)c2)ccc1OCCCc1ccccc1 |r|
Show InChI InChI=1S/C26H31NO5/c1-31-26-16-20(9-12-25(26)32-15-5-8-19-6-3-2-4-7-19)13-14-27-18-24(30)21-10-11-22(28)23(29)17-21/h2-4,6-7,9-12,16-17,24,27-30H,5,8,13-15,18H2,1H3/t24-/m1/s1
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530n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 receptor expressed in HEK293 cells


Bioorg Med Chem 24: 2641-53 (2016)


Article DOI: 10.1016/j.bmc.2016.04.028
BindingDB Entry DOI: 10.7270/Q2ZC84S3
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM25771
PNG
(1-hydroxy-2-naphthoic acid;4-[1-hydroxy-2-[6-(4-ph...)
Show SMILES OCc1cc(ccc1O)C(O)CNCCCCCCOCCCCc1ccccc1
Show InChI InChI=1S/C25H37NO4/c27-20-23-18-22(13-14-24(23)28)25(29)19-26-15-7-1-2-8-16-30-17-9-6-12-21-10-4-3-5-11-21/h3-5,10-11,13-14,18,25-29H,1-2,6-9,12,15-17,19-20H2
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550n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50526689
PNG
(CHEMBL4456505)
Show SMILES COCCc1ccc(OC[C@H](O)CNCCc2ccc(OCCSSCCN)c(OC)c2)cc1 |r|
Show InChI InChI=1S/C25H38N2O5S2/c1-29-13-10-20-3-6-23(7-4-20)32-19-22(28)18-27-12-9-21-5-8-24(25(17-21)30-2)31-14-16-34-33-15-11-26/h3-8,17,22,27-28H,9-16,18-19,26H2,1-2H3/t22-/m1/s1
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740n/an/an/an/an/an/an/an/a



Friedrich-Alexander Universit£t Erlangen-N£rnberg

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 adrenoceptor expressed in HEK293T cell membranes


Bioorg Med Chem 27: 2959-2971 (2019)


Article DOI: 10.1016/j.bmc.2019.05.034
BindingDB Entry DOI: 10.7270/Q2FB56CD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50525107
PNG
(CHEMBL4439238)
Show SMILES CC(C)NC[C@@H](O)COc1ccc(O)c(O)c1 |r|
Show InChI InChI=1S/C12H19NO4/c1-8(2)13-6-9(14)7-17-10-3-4-11(15)12(16)5-10/h3-5,8-9,13-16H,6-7H2,1-2H3/t9-/m1/s1
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860n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50525093
PNG
(CHEMBL4437939)
Show SMILES COc1cc(CCNCCCOc2ccc(O)c(O)c2)ccc1OCCCc1ccccc1
Show InChI InChI=1S/C27H33NO5/c1-31-27-19-22(10-13-26(27)33-17-5-9-21-7-3-2-4-8-21)14-16-28-15-6-18-32-23-11-12-24(29)25(30)20-23/h2-4,7-8,10-13,19-20,28-30H,5-6,9,14-18H2,1H3
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1.20E+3n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50167069
PNG
(CHEMBL3799593)
Show SMILES COc1ccccc1OCCNC[C@@H](O)c1ccc(O)c(O)c1 |r|
Show InChI InChI=1S/C17H21NO5/c1-22-16-4-2-3-5-17(16)23-9-8-18-11-15(21)12-6-7-13(19)14(20)10-12/h2-7,10,15,18-21H,8-9,11H2,1H3/t15-/m1/s1
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1.50E+3n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 receptor expressed in HEK293 cells


Bioorg Med Chem 24: 2641-53 (2016)


Article DOI: 10.1016/j.bmc.2016.04.028
BindingDB Entry DOI: 10.7270/Q2ZC84S3
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50166978
PNG
(CHEMBL3800636)
Show SMILES COc1cc(CCNCCc2ccc(O)c(O)c2)ccc1OCCCc1ccccc1
Show InChI InChI=1S/C26H31NO4/c1-30-26-19-22(14-16-27-15-13-21-9-11-23(28)24(29)18-21)10-12-25(26)31-17-5-8-20-6-3-2-4-7-20/h2-4,6-7,9-12,18-19,27-29H,5,8,13-17H2,1H3
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2.30E+3n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 receptor expressed in HEK293 cells


Bioorg Med Chem 24: 2641-53 (2016)


Article DOI: 10.1016/j.bmc.2016.04.028
BindingDB Entry DOI: 10.7270/Q2ZC84S3
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50525102
PNG
(CHEMBL4459109)
Show SMILES COc1ccccc1OCCNC[C@@H](O)Cc1ccc(O)c(O)c1 |r|
Show InChI InChI=1S/C18H23NO5/c1-23-17-4-2-3-5-18(17)24-9-8-19-12-14(20)10-13-6-7-15(21)16(22)11-13/h2-7,11,14,19-22H,8-10,12H2,1H3/t14-/m0/s1
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2.40E+3n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50167065
PNG
(CHEMBL3797758)
Show SMILES COc1ccccc1OCCNCCc1ccc(O)c(O)c1
Show InChI InChI=1S/C17H21NO4/c1-21-16-4-2-3-5-17(16)22-11-10-18-9-8-13-6-7-14(19)15(20)12-13/h2-7,12,18-20H,8-11H2,1H3
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5.00E+3n/an/an/an/an/an/an/an/a



Friedrich-Alexander University

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from mouse beta1 receptor expressed in HEK293 cells


Bioorg Med Chem 24: 2641-53 (2016)


Article DOI: 10.1016/j.bmc.2016.04.028
BindingDB Entry DOI: 10.7270/Q2ZC84S3
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50525094
PNG
(CHEMBL4515498)
Show SMILES COc1ccccc1OCCNC[C@@H](O)COc1ccc(O)c(O)c1 |r|
Show InChI InChI=1S/C18H23NO6/c1-23-17-4-2-3-5-18(17)24-9-8-19-11-13(20)12-25-14-6-7-15(21)16(22)10-14/h2-7,10,13,19-22H,8-9,11-12H2,1H3/t13-/m1/s1
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7.40E+3n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50525108
PNG
(CHEMBL4459541)
Show SMILES COc1ccccc1OCCNCCCOc1ccc(O)c(O)c1
Show InChI InChI=1S/C18H23NO5/c1-22-17-5-2-3-6-18(17)24-12-10-19-9-4-11-23-14-7-8-15(20)16(21)13-14/h2-3,5-8,13,19-21H,4,9-12H2,1H3
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>1.00E+4n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50525104
PNG
(CHEMBL4518727)
Show SMILES COc1ccccc1OCCNC[C@H](O)Cc1ccc(O)c(O)c1 |r|
Show InChI InChI=1S/C18H23NO5/c1-23-17-4-2-3-5-18(17)24-9-8-19-12-14(20)10-13-6-7-15(21)16(22)11-13/h2-7,11,14,19-22H,8-10,12H2,1H3/t14-/m1/s1
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>1.00E+4n/an/an/an/an/an/an/an/a



Friedrich-Alexander University Erlangen-N£rnberg (FAU)

Curated by ChEMBL


Assay Description
Displacement of [3H]-CGP-12177 from murine beta1-adrenergic receptor expressed in HEK293T cells after 60 mins by radioligand competition binding assa...


J Med Chem 62: 5111-5131 (2019)


Article DOI: 10.1021/acs.jmedchem.9b00349
BindingDB Entry DOI: 10.7270/Q2DZ0CRD
More data for this
Ligand-Target Pair
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