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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'G protein-coupled receptor 44' and Ligand = 'BDBM50397643'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM50397643
PNG
(CHEMBL2181803)
Show SMILES Cc1c(CC(O)=O)c2ccc(F)cn2c1Sc1ccc(cc1F)S(C)(=O)=O
Show InChI InChI=1S/C18H15F2NO4S2/c1-10-13(8-17(22)23)15-5-3-11(19)9-21(15)18(10)26-16-6-4-12(7-14(16)20)27(2,24)25/h3-7,9H,8H2,1-2H3,(H,22,23)
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
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GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
0.200n/an/an/an/an/an/an/an/a



Oxagen Ltd.

Curated by ChEMBL


Assay Description
Displacement of [3H]PGD2 from CRTH2 expressed in HEK293 cells after 3 hrs by liquid scintillation counting


J Med Chem 55: 2915-31 (2012)


Article DOI: 10.1021/jm2013997
More data for this
Ligand-Target Pair