Found 8 hits in this display Target/Host
(Institution) | Ligand | Target/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 | pH | Temp
°C |
|---|
Beta-1 adrenergic receptor
(Mus musculus) | BDBM50525097
(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 | PDB
UniProtKB/SwissProt
GoogleScholar
AffyNet 
| PC cid
PC sid
UniChem
| Article
PubMed
| 6.5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/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-2 adrenergic receptor
(Homo sapiens (Human)) | BDBM50525097
(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 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| 7.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Friedrich-Alexander University Erlangen-N£rnberg (FAU)
Curated by ChEMBL
| Assay Description
Displacement of [3H]-CGP-12177 from human beta2-adrenergic receptor expressed in CHO cells after 60 mins by radioligand competition binding assay |
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-2 adrenergic receptor
(Homo sapiens (Human)) | BDBM50525097
(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 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a |
Friedrich-Alexander University Erlangen-N£rnberg (FAU)
Curated by ChEMBL
| Assay Description
Agonist activity at beta2-adrenergic receptor (unknown origin) expressed in HEK293T cells harboring GFP/Rluc2-tagged beta-arrestin2 assessed as incre... |
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
(Homo sapiens (Human)) | BDBM50525097
(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 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.51E+3 | n/a | n/a | n/a | n/a |
Friedrich-Alexander University Erlangen-N£rnberg (FAU)
Curated by ChEMBL
| Assay Description
Agonist activity at beta1-adrenergic receptor (unknown origin) expressed in HEK293T cells harboring GFP/Rluc2-tagged beta-arrestin2 assessed as incre... |
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
(Homo sapiens (Human)) | BDBM50525097
(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 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.00E+4 | n/a | n/a | n/a | n/a |
Friedrich-Alexander University Erlangen-N£rnberg (FAU)
Curated by ChEMBL
| Assay Description
Agonist activity at beta1-adrenergic receptor (unknown origin) expressed in HEK293T cells harboring GFP/Rluc2-tagged beta-arrestin2 assessed as incre... |
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
(Homo sapiens (Human)) | BDBM50525097
(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 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 7.94E+3 | n/a | n/a | n/a | n/a |
Friedrich-Alexander University Erlangen-N£rnberg (FAU)
Curated by ChEMBL
| Assay Description
Agonist activity at beta1-adrenergic receptor (unknown origin) expressed in HEK293T cells harboring GFP/Rluc2-tagged beta-arrestin2 assessed as incre... |
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-2 adrenergic receptor
(Homo sapiens (Human)) | BDBM50525097
(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 | PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 1.26E+4 | n/a | n/a | n/a | n/a |
Friedrich-Alexander University Erlangen-N£rnberg (FAU)
Curated by ChEMBL
| Assay Description
Agonist activity at beta2-adrenergic receptor (unknown origin) expressed in HEK293T cells harboring Rluc2-117-GalphaS/GFP10-Ggamma/Gbeta1 assessed as... |
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
(Homo sapiens (Human)) | BDBM50525097
(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 | PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
AffyNet
| PC cid
PC sid
UniChem
| Article
PubMed
| n/a | n/a | n/a | n/a | 2.51E+3 | n/a | n/a | n/a | n/a |
Friedrich-Alexander University Erlangen-N£rnberg (FAU)
Curated by ChEMBL
| Assay Description
Agonist activity at beta1-adrenergic receptor (unknown origin) expressed in HEK293T cells harboring Rluc2-117-GalphaS/GFP10-Ggamma/Gbeta1 assessed as... |
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 | |