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BDBM50444780 CHEMBL3099129

SMILES: Cc1c(Cc2ccccc2S(=O)(=O)c2ccccc2)c(nn1CC(O)=O)-c1cccc(c1)C(F)(F)F

InChI Key: InChIKey=YHLPFCXVIMKKRH-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50444780   
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))
BDBM50444780
PNG
(CHEMBL3099129)
Show SMILES Cc1c(Cc2ccccc2S(=O)(=O)c2ccccc2)c(nn1CC(O)=O)-c1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C26H21F3N2O4S/c1-17-22(15-18-8-5-6-13-23(18)36(34,35)21-11-3-2-4-12-21)25(30-31(17)16-24(32)33)19-9-7-10-20(14-19)26(27,28)29/h2-14H,15-16H2,1H3,(H,32,33)
PDB

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Similars

Article
PubMed
n/an/a 50n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 (unknown origin) expressed in CHO.K1 cells assessed as inhibition of PGD2-induced [35S]-GTPgammaS binding after 2 hrs by...


Eur J Med Chem 71: 168-84 (2014)


Article DOI: 10.1016/j.ejmech.2013.10.072
BindingDB Entry DOI: 10.7270/Q2GB25HZ
More data for this
Ligand-Target Pair