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BDBM50019084 CHEMBL3288345

SMILES: Cc1cccc(C)c1-c1cccc(COc2ccc(CCC(O)=O)nc2)c1

InChI Key: InChIKey=QZQNRYAAFCCMPX-UHFFFAOYSA-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 = 50019084   
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
Free fatty acid receptor 1


(Rattus norvegicus)
BDBM50019084
PNG
(CHEMBL3288345)
Show SMILES Cc1cccc(C)c1-c1cccc(COc2ccc(CCC(O)=O)nc2)c1
Show InChI InChI=1S/C23H23NO3/c1-16-5-3-6-17(2)23(16)19-8-4-7-18(13-19)15-27-21-11-9-20(24-14-21)10-12-22(25)26/h3-9,11,13-14H,10,12,15H2,1-2H3,(H,25,26)
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KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 210n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at rat GPR40 expressed in CHO cells by calcium flux assay


Bioorg Med Chem Lett 24: 2949-53 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.065
BindingDB Entry DOI: 10.7270/Q2WD424Z
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50019084
PNG
(CHEMBL3288345)
Show SMILES Cc1cccc(C)c1-c1cccc(COc2ccc(CCC(O)=O)nc2)c1
Show InChI InChI=1S/C23H23NO3/c1-16-5-3-6-17(2)23(16)19-8-4-7-18(13-19)15-27-21-11-9-20(24-14-21)10-12-22(25)26/h3-9,11,13-14H,10,12,15H2,1-2H3,(H,25,26)
PDB

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UniProtKB/SwissProt

antibodypedia
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 71n/an/an/an/a



Daiichi Sankyo Co., Ltd

Curated by ChEMBL


Assay Description
Agonist activity at human GPR40 expressed in CHO cells by calcium flux assay


Bioorg Med Chem Lett 24: 2949-53 (2014)


Article DOI: 10.1016/j.bmcl.2014.04.065
BindingDB Entry DOI: 10.7270/Q2WD424Z
More data for this
Ligand-Target Pair