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BDBM50309406 2-(2-((3'-cyanobiphenyl-2-yl)methyl)-4-(4-fluorophenyl)thiazol-5-yl)acetic acid::CHEMBL603187

SMILES: OC(=O)Cc1sc(Cc2ccccc2-c2cccc(c2)C#N)nc1-c1ccc(F)cc1

InChI Key: InChIKey=SYRMYDRBDXUBHO-UHFFFAOYSA-N

Data: 2 IC50

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50309406   
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
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM50309406
PNG
(2-(2-((3'-cyanobiphenyl-2-yl)methyl)-4-(4-fluoroph...)
Show SMILES OC(=O)Cc1sc(Cc2ccccc2-c2cccc(c2)C#N)nc1-c1ccc(F)cc1
Show InChI InChI=1S/C25H17FN2O2S/c26-20-10-8-17(9-11-20)25-22(14-24(29)30)31-23(28-25)13-19-5-1-2-7-21(19)18-6-3-4-16(12-18)15-27/h1-12H,13-14H2,(H,29,30)
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UniProtKB/SwissProt

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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 340n/an/an/an/an/an/a



7TM Pharma A/S

Curated by ChEMBL


Assay Description
Displacement of[3H]PGD2 from human CRTH2 receptor expressed in african green monkey COS7 cells


Bioorg Med Chem Lett 20: 1177-80 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.008
BindingDB Entry DOI: 10.7270/Q25T3KMP
More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM50309406
PNG
(2-(2-((3'-cyanobiphenyl-2-yl)methyl)-4-(4-fluoroph...)
Show SMILES OC(=O)Cc1sc(Cc2ccccc2-c2cccc(c2)C#N)nc1-c1ccc(F)cc1
Show InChI InChI=1S/C25H17FN2O2S/c26-20-10-8-17(9-11-20)25-22(14-24(29)30)31-23(28-25)13-19-5-1-2-7-21(19)18-6-3-4-16(12-18)15-27/h1-12H,13-14H2,(H,29,30)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a>1.00E+5n/an/an/an/an/an/a



7TM Pharma A/S

Curated by ChEMBL


Assay Description
Antagonist activity at human CRTH2 receptor expressed in HEK285-7 cells assessed as inhibition of beta arrestin translocation by bioluminescence reso...


Bioorg Med Chem Lett 20: 1177-80 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.008
BindingDB Entry DOI: 10.7270/Q25T3KMP
More data for this
Ligand-Target Pair