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BDBM50196399 CHEMBL3932897

SMILES: Cc1ccc(Oc2cc(F)cc(c2)N2Cc3ccccc3S2(=O)=O)cc1

InChI Key: InChIKey=WZUTVZOKMNJYBG-UHFFFAOYSA-N

Data: 1 IC50  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 3 hits for monomerid = 50196399   
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 4


(Homo sapiens (Human))
BDBM50196399
PNG
(CHEMBL3932897)
Show SMILES Cc1ccc(Oc2cc(F)cc(c2)N2Cc3ccccc3S2(=O)=O)cc1
Show InChI InChI=1S/C20H16FNO3S/c1-14-6-8-18(9-7-14)25-19-11-16(21)10-17(12-19)22-13-15-4-2-3-5-20(15)26(22,23)24/h2-12H,13H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 437n/an/an/an/a



University of Southern Denmark

Curated by ChEMBL


Assay Description
Agonist activity at C-terminal YFP-tagged human FFA4 expressed in HEK293 cells in presence of coelentrazine h by BRET based beta-arrestin-2 interacti...


J Med Chem 59: 8868-8878 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00685
BindingDB Entry DOI: 10.7270/Q2C53NS2
More data for this
Ligand-Target Pair
Free fatty acid receptor 4


(Homo sapiens (Human))
BDBM50196399
PNG
(CHEMBL3932897)
Show SMILES Cc1ccc(Oc2cc(F)cc(c2)N2Cc3ccccc3S2(=O)=O)cc1
Show InChI InChI=1S/C20H16FNO3S/c1-14-6-8-18(9-7-14)25-19-11-16(21)10-17(12-19)22-13-15-4-2-3-5-20(15)26(22,23)24/h2-12H,13H2,1H3
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 1.10E+3n/an/an/an/a



University of Southern Denmark

Curated by ChEMBL


Assay Description
Agonist activity at human FFA4 expressed in human Flp-In T-REx293 cells by Fura2-AM dye based calcium mobilization assay


J Med Chem 59: 8868-8878 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00685
BindingDB Entry DOI: 10.7270/Q2C53NS2
More data for this
Ligand-Target Pair
Free fatty acid receptor 1


(Homo sapiens (Human))
BDBM50196399
PNG
(CHEMBL3932897)
Show SMILES Cc1ccc(Oc2cc(F)cc(c2)N2Cc3ccccc3S2(=O)=O)cc1
Show InChI InChI=1S/C20H16FNO3S/c1-14-6-8-18(9-7-14)25-19-11-16(21)10-17(12-19)22-13-15-4-2-3-5-20(15)26(22,23)24/h2-12H,13H2,1H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 2.88E+3n/an/an/an/an/an/a



University of Southern Denmark

Curated by ChEMBL


Assay Description
Antagonist activity against human FFA1 expressed in human Flp-In T-REx293 cells assessed as as reduction in TUG424-induced response by Fura2-AM dye b...


J Med Chem 59: 8868-8878 (2016)


Article DOI: 10.1021/acs.jmedchem.6b00685
BindingDB Entry DOI: 10.7270/Q2C53NS2
More data for this
Ligand-Target Pair