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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Prostaglandin D2 receptor' and Ligand = 'BDBM50128699'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Prostaglandin D2 receptor


(Homo sapiens (Human))
BDBM50128699
PNG
((+) (E) 7-[3-(5-Styryl-thiophene-2-sulfonylamino)-...)
Show SMILES OC(=O)CCC\C=C/C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(\C=C\c2ccccc2)s1
Show InChI InChI=1S/C26H31NO4S2/c28-24(29)11-7-2-1-6-10-23-20-13-14-21(18-20)26(23)27-33(30,31)25-17-16-22(32-25)15-12-19-8-4-3-5-9-19/h1,3-6,8-9,12,15-17,20-21,23,26-27H,2,7,10-11,13-14,18H2,(H,28,29)/b6-1-,15-12+/t20-,21+,23+,26+/m0/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 90n/an/an/an/an/an/a



Shionogi & Co., Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of [3H]- PGD-2 radioligand binding to prostaglandin D2 receptor on human platelet membrane


J Med Chem 46: 2436-45 (2003)


Article DOI: 10.1021/jm020517g
BindingDB Entry DOI: 10.7270/Q2154GFS
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor


(Homo sapiens (Human))
BDBM50128699
PNG
((+) (E) 7-[3-(5-Styryl-thiophene-2-sulfonylamino)-...)
Show SMILES OC(=O)CCC\C=C/C[C@@H]1[C@H]2CC[C@H](C2)[C@H]1NS(=O)(=O)c1ccc(\C=C\c2ccccc2)s1
Show InChI InChI=1S/C26H31NO4S2/c28-24(29)11-7-2-1-6-10-23-20-13-14-21(18-20)26(23)27-33(30,31)25-17-16-22(32-25)15-12-19-8-4-3-5-9-19/h1,3-6,8-9,12,15-17,20-21,23,26-27H,2,7,10-11,13-14,18H2,(H,28,29)/b6-1-,15-12+/t20-,21+,23+,26+/m0/s1
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 100n/an/an/an/an/an/a



Shionogi & Co., Ltd.

Curated by ChEMBL


Assay Description
In vitro inhibition of cAMP formation evoked by prostaglandin D2 receptor in human platelets


J Med Chem 46: 2436-45 (2003)


Article DOI: 10.1021/jm020517g
BindingDB Entry DOI: 10.7270/Q2154GFS
More data for this
Ligand-Target Pair