BindingDB logo
myBDB logout

BDBM124844 US8759386, 41

SMILES: CCn1c(cc2ccc(F)cc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)c(F)c1

InChI Key: InChIKey=WTABVCIEPJSJHQ-UHFFFAOYSA-N

Data: 1 KI

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 1 hit for monomerid = 124844   
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))
BDBM124844
PNG
(US8759386, 41)
Show SMILES CCn1c(cc2ccc(F)cc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)c(F)c1
Show InChI InChI=1S/C25H24F2N4O3/c1-4-30-22-10-18(26)7-5-16(22)9-23(30)25(34)28-19-8-6-17(21(27)11-19)13-31-15(3)20(12-24(32)33)14(2)29-31/h5-11H,4,12-13H2,1-3H3,(H,28,34)(H,32,33)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
0.100 -13.6n/an/an/an/an/a7.425



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)


BindingDB Entry DOI: 10.7270/Q2S46QM5
More data for this
Ligand-Target Pair