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SMILES: CCN(Cc1cc(ccc1-c1nn(CC(O)=O)c2ccc(Cl)c(F)c12)C(F)(F)F)C(=O)C1CC1

InChI Key: InChIKey=CUPMQTQEACOERL-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50034969   
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
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50034969
PNG
(CHEMBL3343001)
Show SMILES CCN(Cc1cc(ccc1-c1nn(CC(O)=O)c2ccc(Cl)c(F)c12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C23H20ClF4N3O3/c1-2-30(22(34)12-3-4-12)10-13-9-14(23(26,27)28)5-6-15(13)21-19-17(8-7-16(24)20(19)25)31(29-21)11-18(32)33/h5-9,12H,2-4,10-11H2,1H3,(H,32,33)
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PC sid
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Article
PubMed
n/an/a 18n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor in human whole blood assessed as inhibition of PGD2-induced eosinophil shape change preincubated for 10 mins wi...


Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor 2


(Homo sapiens (Human))
BDBM50034969
PNG
(CHEMBL3343001)
Show SMILES CCN(Cc1cc(ccc1-c1nn(CC(O)=O)c2ccc(Cl)c(F)c12)C(F)(F)F)C(=O)C1CC1
Show InChI InChI=1S/C23H20ClF4N3O3/c1-2-30(22(34)12-3-4-12)10-13-9-14(23(26,27)28)5-6-15(13)21-19-17(8-7-16(24)20(19)25)31(29-21)11-18(32)33/h5-9,12H,2-4,10-11H2,1H3,(H,32,33)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 15n/an/an/an/an/an/a



Rhône-Poulenc Rorer

Curated by ChEMBL


Assay Description
Antagonist activity at CRTh2 receptor (unknown origin) overexpressed in CHOK1 cell membranes assessed as inhibition of [35S]-GTPgammaS binding measur...


Bioorg Med Chem Lett 24: 5123-6 (2014)


Article DOI: 10.1016/j.bmcl.2014.08.029
BindingDB Entry DOI: 10.7270/Q2CF9RRW
More data for this
Ligand-Target Pair