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BDBM50416068 CHEMBL1083884

SMILES: OCCOCCCCCCNC[C@H](O)c1ccc(O)c(CO)c1

InChI Key: InChIKey=BOBWIDWDXFEGNK-KRWDZBQOSA-N

Data: 3 EC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50416068   
Target/Host
(Institution)
LigandTarget/Host
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-2 adrenergic receptor


(Homo sapiens (Human))
BDBM50416068
PNG
(CHEMBL1083884)
Show SMILES OCCOCCCCCCNC[C@H](O)c1ccc(O)c(CO)c1 |r|
Show InChI InChI=1S/C17H29NO5/c19-8-10-23-9-4-2-1-3-7-18-12-17(22)14-5-6-16(21)15(11-14)13-20/h5-6,11,17-22H,1-4,7-10,12-13H2/t17-/m0/s1
PDB
MMDB

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Article
PubMed
n/an/an/an/a 2.51E+3n/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant beta2 adrenergic receptor expressed in CHO cells assessed as induction of intracellular cAMP accumulation after...


J Med Chem 53: 4522-30 (2010)


Article DOI: 10.1021/jm100326d
BindingDB Entry DOI: 10.7270/Q23N24N1
More data for this
Ligand-Target Pair
Beta-1 adrenergic receptor


(Homo sapiens (Human))
BDBM50416068
PNG
(CHEMBL1083884)
Show SMILES OCCOCCCCCCNC[C@H](O)c1ccc(O)c(CO)c1 |r|
Show InChI InChI=1S/C17H29NO5/c19-8-10-23-9-4-2-1-3-7-18-12-17(22)14-5-6-16(21)15(11-14)13-20/h5-6,11,17-22H,1-4,7-10,12-13H2/t17-/m0/s1
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Article
PubMed
n/an/an/an/a<2.51E+4n/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant beta-1 adrenergic receptor expressed in CHO cells assessed as induction of intracellular cAMP accumulation afte...


J Med Chem 53: 4522-30 (2010)


Article DOI: 10.1021/jm100326d
BindingDB Entry DOI: 10.7270/Q23N24N1
More data for this
Ligand-Target Pair
Beta-3 adrenergic receptor


(Homo sapiens (Human))
BDBM50416068
PNG
(CHEMBL1083884)
Show SMILES OCCOCCCCCCNC[C@H](O)c1ccc(O)c(CO)c1 |r|
Show InChI InChI=1S/C17H29NO5/c19-8-10-23-9-4-2-1-3-7-18-12-17(22)14-5-6-16(21)15(11-14)13-20/h5-6,11,17-22H,1-4,7-10,12-13H2/t17-/m0/s1
PDB

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KEGG

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UniProtKB/TrEMBL

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antibodypedia
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PC cid
PC sid
UniChem

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Article
PubMed
n/an/an/an/a 1.26E+4n/an/an/an/a



GlaxoSmithKline Medicines Research Centre

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant beta3 adrenergic receptor expressed in CHO cells assessed as induction of intracellular cAMP accumulation after...


J Med Chem 53: 4522-30 (2010)


Article DOI: 10.1021/jm100326d
BindingDB Entry DOI: 10.7270/Q23N24N1
More data for this
Ligand-Target Pair