BindingDB logo
myBDB logout

BDBM50243298 4-((2R)-2-{[(2R)-2-Phenyl-2-hydroxyethyl]amino}propyl)-3-cyclohexyloxy-1,1-biphenyl-4-carboxylic acid::CHEMBL509156

SMILES: C[C@H](Cc1ccc(cc1)-c1ccc(C(O)=O)c(OC2CCCCC2)c1)NC[C@H](O)c1ccccc1

InChI Key: InChIKey=BTGYMCRAGAZJTI-GWYPAGIBNA-N

Data: 2 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 2 hits for monomerid = 50243298   
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-1 adrenergic receptor


(Homo sapiens (Human))
BDBM50243298
PNG
(4-((2R)-2-{[(2R)-2-Phenyl-2-hydroxyethyl]amino}pro...)
Show SMILES C[C@H](Cc1ccc(cc1)-c1ccc(C(O)=O)c(OC2CCCCC2)c1)NC[C@H](O)c1ccccc1
Show InChI InChI=1/C30H35NO4/c1-21(31-20-28(32)24-8-4-2-5-9-24)18-22-12-14-23(15-13-22)25-16-17-27(30(33)34)29(19-25)35-26-10-6-3-7-11-26/h2,4-5,8-9,12-17,19,21,26,28,31-32H,3,6-7,10-11,18,20H2,1H3,(H,33,34)/t21-,28+/s2
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 28n/an/an/an/a



Astellas Pharma Inc

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant beta-1 adrenergic receptor expressed in CHO cells assessed as cAMP accumulation by enzyme immuno assay


J Med Chem 51: 4002-20 (2008)


Article DOI: 10.1021/jm8000345
BindingDB Entry DOI: 10.7270/Q2MS3SKD
More data for this
Ligand-Target Pair
Beta-3 adrenergic receptor


(Homo sapiens (Human))
BDBM50243298
PNG
(4-((2R)-2-{[(2R)-2-Phenyl-2-hydroxyethyl]amino}pro...)
Show SMILES C[C@H](Cc1ccc(cc1)-c1ccc(C(O)=O)c(OC2CCCCC2)c1)NC[C@H](O)c1ccccc1
Show InChI InChI=1/C30H35NO4/c1-21(31-20-28(32)24-8-4-2-5-9-24)18-22-12-14-23(15-13-22)25-16-17-27(30(33)34)29(19-25)35-26-10-6-3-7-11-26/h2,4-5,8-9,12-17,19,21,26,28,31-32H,3,6-7,10-11,18,20H2,1H3,(H,33,34)/t21-,28+/s2
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 0.0420n/an/an/an/a



Astellas Pharma Inc

Curated by ChEMBL


Assay Description
Agonist activity at human recombinant beta3 adrenergic receptor expressed in CHO cells assessed as cAMP accumulation by enzyme immuno assay


J Med Chem 51: 4002-20 (2008)


Article DOI: 10.1021/jm8000345
BindingDB Entry DOI: 10.7270/Q2MS3SKD
More data for this
Ligand-Target Pair