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BDBM50309265 2-(2-((4-chlorophenoxy)methyl)-4-(4-chlorophenyl)thiazol-5-yl)acetic acid::CHEMBL602438

SMILES: OC(=O)Cc1sc(COc2ccc(Cl)cc2)nc1-c1ccc(Cl)cc1

InChI Key: InChIKey=MYIQJEVYQYVXCY-UHFFFAOYSA-N

Data: 2 IC50

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 = 50309265   
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))
BDBM50309265
PNG
(2-(2-((4-chlorophenoxy)methyl)-4-(4-chlorophenyl)t...)
Show SMILES OC(=O)Cc1sc(COc2ccc(Cl)cc2)nc1-c1ccc(Cl)cc1
Show InChI InChI=1S/C18H13Cl2NO3S/c19-12-3-1-11(2-4-12)18-15(9-17(22)23)25-16(21-18)10-24-14-7-5-13(20)6-8-14/h1-8H,9-10H2,(H,22,23)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 370n/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: 1181-5 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.015
BindingDB Entry DOI: 10.7270/Q2PR7W35
More data for this
Ligand-Target Pair
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM50309265
PNG
(2-(2-((4-chlorophenoxy)methyl)-4-(4-chlorophenyl)t...)
Show SMILES OC(=O)Cc1sc(COc2ccc(Cl)cc2)nc1-c1ccc(Cl)cc1
Show InChI InChI=1S/C18H13Cl2NO3S/c19-12-3-1-11(2-4-12)18-15(9-17(22)23)25-16(21-18)10-24-14-7-5-13(20)6-8-14/h1-8H,9-10H2,(H,22,23)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
GoogleScholar
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 32n/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 HEK385-7 cells


Bioorg Med Chem Lett 20: 1181-5 (2010)


Article DOI: 10.1016/j.bmcl.2009.12.015
BindingDB Entry DOI: 10.7270/Q2PR7W35
More data for this
Ligand-Target Pair