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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Prostanoid DP receptor' and Ligand = 'BDBM50331743'   
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
Prostanoid DP receptor


(Homo sapiens (Human))
BDBM50331743
PNG
(2-((R)-9-((R)-1-(4-chlorophenyl)-2,2-difluoroethyl...)
Show SMILES CS(=O)(=O)c1cc(F)cc2c3CCC[C@H](CC(O)=O)c3n([C@@H](C(F)F)c3ccc(Cl)cc3)c12 |r|
Show InChI InChI=1S/C23H21ClF3NO4S/c1-33(31,32)18-11-15(25)10-17-16-4-2-3-13(9-19(29)30)20(16)28(22(17)18)21(23(26)27)12-5-7-14(24)8-6-12/h5-8,10-11,13,21,23H,2-4,9H2,1H3,(H,29,30)/t13-,21-/m1/s1
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PC cid
PC sid
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Patents

Article
PubMed
0.390n/an/an/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Antagonist activity at prostanoid DP1 receptor


Bioorg Med Chem Lett 20: 7462-5 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.018
BindingDB Entry DOI: 10.7270/Q2PZ5920
More data for this
Ligand-Target Pair