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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'G protein-coupled receptor 44' and Ligand = 'BDBM124806'   
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
G protein-coupled receptor 44


(Homo sapiens (Human))
BDBM124806
PNG
(US8759386, 3)
Show SMILES Cc1nn(Cc2ccc(NC(=O)c3cc4ccccc4n3Cc3ccccc3)cc2F)c(C)c1CC(O)=O
Show InChI InChI=1S/C30H27FN4O3/c1-19-25(16-29(36)37)20(2)35(33-19)18-23-12-13-24(15-26(23)31)32-30(38)28-14-22-10-6-7-11-27(22)34(28)17-21-8-4-3-5-9-21/h3-15H,16-18H2,1-2H3,(H,32,38)(H,36,37)
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PC cid
PC sid
UniChem
US Patent
0.200 -55.4n/an/an/an/an/a7.425



Boehringer Ingelheim International GmbH

US Patent


Assay Description
The CRTH2 receptor binding assay is performed in a scintillation proximity assay (SPA) format with the radioligand [3H]-PGD2 (Perkin Elmer, NET616000...


US Patent US8759386 (2014)

More data for this
Ligand-Target Pair