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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 = 'BDBM50150973'   
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


(Mus musculus)
BDBM50150973
PNG
(CHEMBL362541 | [1-(4-Butoxy-benzoyl)-5-methoxy-2-m...)
Show SMILES CCCCOc1ccc(cc1)C(=O)n1c(C)c(CC(O)=O)c2cc(OC)ccc12
Show InChI InChI=1S/C23H25NO5/c1-4-5-12-29-17-8-6-16(7-9-17)23(27)24-15(2)19(14-22(25)26)20-13-18(28-3)10-11-21(20)24/h6-11,13H,4-5,12,14H2,1-3H3,(H,25,26)
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UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
270n/an/an/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Binding affinity for mouse Prostanoid DP receptor


Bioorg Med Chem Lett 14: 4557-62 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.006
BindingDB Entry DOI: 10.7270/Q2N29XPR
More data for this
Ligand-Target Pair
Prostaglandin D2 receptor


(Mus musculus)
BDBM50150973
PNG
(CHEMBL362541 | [1-(4-Butoxy-benzoyl)-5-methoxy-2-m...)
Show SMILES CCCCOc1ccc(cc1)C(=O)n1c(C)c(CC(O)=O)c2cc(OC)ccc12
Show InChI InChI=1S/C23H25NO5/c1-4-5-12-29-17-8-6-16(7-9-17)23(27)24-15(2)19(14-22(25)26)20-13-18(28-3)10-11-21(20)24/h6-11,13H,4-5,12,14H2,1-3H3,(H,25,26)
Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.60E+3n/an/an/an/an/an/a



Minase Research Institute

Curated by ChEMBL


Assay Description
Inhibition of mouse Prostanoid DP receptor


Bioorg Med Chem Lett 14: 4557-62 (2004)


Article DOI: 10.1016/j.bmcl.2004.06.006
BindingDB Entry DOI: 10.7270/Q2N29XPR
More data for this
Ligand-Target Pair