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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Beta-1 adrenergic receptor' and Ligand = 'BDBM50404763'   
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)
BDBM50404763
PNG
(CHEMBL283289)
Show SMILES CCOC(=O)CCNCC(O)COc1ccccc1C
Show InChI InChI=1S/C15H23NO4/c1-3-19-15(18)8-9-16-10-13(17)11-20-14-7-5-4-6-12(14)2/h4-7,13,16-17H,3,8-11H2,1-2H3
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 0.0000100n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vivo inihibition of Beta-1 adrenergic receptor in guinea pig right atria after 40 min


J Med Chem 25: 1402-7 (1983)


Article DOI: 10.1021/jm00354a002
BindingDB Entry DOI: 10.7270/Q2WQ0500
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(GUINEA PIG)
BDBM50404763
PNG
(CHEMBL283289)
Show SMILES CCOC(=O)CCNCC(O)COc1ccccc1C
Show InChI InChI=1S/C15H23NO4/c1-3-19-15(18)8-9-16-10-13(17)11-20-14-7-5-4-6-12(14)2/h4-7,13,16-17H,3,8-11H2,1-2H3
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 32n/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
In vitro ability to block beta-1 adrenergic receptor in guinea pig right atria.


J Med Chem 25: 1402-7 (1983)


Article DOI: 10.1021/jm00354a002
BindingDB Entry DOI: 10.7270/Q2WQ0500
More data for this
Ligand-Target Pair