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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostaglandin D2 receptor' and Ligand = 'BDBM50417755'   
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))		BDBM50417755
PNG
(CHEMBL1644257)
Show SMILES COc1ccc(CCNc2cc(nc(OC)n2)-c2ccc3OCCc3c2)cc1
Show InChI InChI=1S/C22H23N3O3/c1-26-18-6-3-15(4-7-18)9-11-23-21-14-19(24-22(25-21)27-2)16-5-8-20-17(13-16)10-12-28-20/h3-8,13-14H,9-12H2,1-2H3,(H,23,24,25)
UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars
Article
PubMed
n/an/a 12.9n/an/an/an/an/an/a



Sanofi Aventis US

Curated by ChEMBL


Assay Description
Antagonist activity at prostaglandin D2 receptor in human LS174T cells assessed as inhibition of PGD2-induced cAMP accumulation after 15 mins by scin...

Bioorg Med Chem Lett 21: 66-75 (2010)


Article DOI: 10.1016/j.bmcl.2010.11.071
BindingDB Entry DOI: 10.7270/Q22F7PPM
More data for this
Ligand-Target Pair