BindingDB logo
myBDB logout

null

SMILES: CCn1c(cc2c(F)cccc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)c(F)c1

InChI Key: InChIKey=BXABTEWCRRNKHC-UHFFFAOYSA-N

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 = 124843   
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))		BDBM124843
PNG
(US8759386, 40)
Show SMILES CCn1c(cc2c(F)cccc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)c(F)c1
Show InChI InChI=1S/C25H24F2N4O3/c1-4-30-22-7-5-6-20(26)19(22)11-23(30)25(34)28-17-9-8-16(21(27)10-17)13-31-15(3)18(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
 0.400 -12.8n/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