BindingDB logo
myBDB logout

BDBM119852 US8691993, 1

SMILES: OC(=O)Cc1cc(C2CCN(CC2)S(=O)(=O)c2ccccc2)c2cc(F)ccc2c1

InChI Key: InChIKey=UVLLQCHNYUAHEP-UHFFFAOYSA-N

Data: 1 IC50

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 = 119852   
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))
BDBM119852
PNG
(US8691993, 1)
Show SMILES OC(=O)Cc1cc(C2CCN(CC2)S(=O)(=O)c2ccccc2)c2cc(F)ccc2c1
Show InChI InChI=1S/C23H22FNO4S/c24-19-7-6-18-12-16(14-23(26)27)13-21(22(18)15-19)17-8-10-25(11-9-17)30(28,29)20-4-2-1-3-5-20/h1-7,12-13,15,17H,8-11,14H2,(H,26,27)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 18n/an/an/an/an/a37



Hoffmann-La Roche Inc.

US Patent


Assay Description
Calcium Flux Assay Using Fluorometric Imaging Plate Reader (FLIPR). Buffer containing dye (from the FLIPR® Calcium 3 Assay Kit from Molecular D...


US Patent US8691993 (2014)


BindingDB Entry DOI: 10.7270/Q2348J11
More data for this
Ligand-Target Pair