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Compile Data Set for Download or QSAR

Found 4 hits of ki for monomerid = 50213117   
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-2 adrenergic receptor


(Homo sapiens (Human))
BDBM50213117
PNG
((R,R)-(-)-5-[1-hydroxy-2-(1-methyl-2-phenylethylam...)
Show SMILES C[C@H](Cc1ccc(N)cc1)NC[C@H](O)c1cc(O)cc(O)c1
Show InChI InChI=1S/C17H22N2O3/c1-11(6-12-2-4-14(18)5-3-12)19-10-17(22)13-7-15(20)9-16(21)8-13/h2-5,7-9,11,17,19-22H,6,10,18H2,1H3/t11-,17+/m1/s1
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Article
PubMed
1.90E+3n/an/an/an/an/an/an/an/a



Medical University of Lublin

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP12177 from human beta-2 adrenergic receptor expressed in HEK293 cells


J Med Chem 50: 2903-15 (2007)


Article DOI: 10.1021/jm070030d
BindingDB Entry DOI: 10.7270/Q2R2112T
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Rattus norvegicus (Rat))
BDBM50213117
PNG
((R,R)-(-)-5-[1-hydroxy-2-(1-methyl-2-phenylethylam...)
Show SMILES C[C@H](Cc1ccc(N)cc1)NC[C@H](O)c1cc(O)cc(O)c1
Show InChI InChI=1S/C17H22N2O3/c1-11(6-12-2-4-14(18)5-3-12)19-10-17(22)13-7-15(20)9-16(21)8-13/h2-5,7-9,11,17,19-22H,6,10,18H2,1H3/t11-,17+/m1/s1
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Article
PubMed
1.72E+4n/an/an/an/an/an/an/an/a



Medical University of Lublin

Curated by ChEMBL


Assay Description
Displacement of [3H]CGP-12177 from beta-1 adrenergic receptor in Sprague-Dawley rat cortical membrane


J Med Chem 50: 2903-15 (2007)


Article DOI: 10.1021/jm070030d
BindingDB Entry DOI: 10.7270/Q2R2112T
More data for this
Ligand-Target Pair
Beta-2 adrenergic receptor


(Homo sapiens (Human))
BDBM50213117
PNG
((R,R)-(-)-5-[1-hydroxy-2-(1-methyl-2-phenylethylam...)
Show SMILES C[C@H](Cc1ccc(N)cc1)NC[C@H](O)c1cc(O)cc(O)c1
Show InChI InChI=1S/C17H22N2O3/c1-11(6-12-2-4-14(18)5-3-12)19-10-17(22)13-7-15(20)9-16(21)8-13/h2-5,7-9,11,17,19-22H,6,10,18H2,1H3/t11-,17+/m1/s1
PDB
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US Patent
1.86E+6n/an/an/an/an/an/an/an/a



The USA, as represented by the Secretary, Department of Health and Human Services; SRI International

US Patent


Assay Description
HEK 293 cells stability transfected with cDNA encoding human β2-AR (provided by Dr. Brian Kobilka, Stanford Medical Center, Palo Alto, Calif.) w...


US Patent US10617654 (2020)


BindingDB Entry DOI: 10.7270/Q2N3010Z
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Mus musculus)
BDBM50213117
PNG
((R,R)-(-)-5-[1-hydroxy-2-(1-methyl-2-phenylethylam...)
Show SMILES C[C@H](Cc1ccc(N)cc1)NC[C@H](O)c1cc(O)cc(O)c1
Show InChI InChI=1S/C17H22N2O3/c1-11(6-12-2-4-14(18)5-3-12)19-10-17(22)13-7-15(20)9-16(21)8-13/h2-5,7-9,11,17,19-22H,6,10,18H2,1H3/t11-,17+/m1/s1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

US Patent
1.72E+7n/an/an/an/an/an/an/an/a



The USA, as represented by the Secretary, Department of Health and Human Services; SRI International

US Patent


Assay Description
β1-AR binding was done on rat cortical membrane following a previously described procedure (Beer et al., Biochem. Pharmacol. 37: 1145-1151, 1988...


US Patent US10617654 (2020)


BindingDB Entry DOI: 10.7270/Q2N3010Z
More data for this
Ligand-Target Pair