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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 = 'BDBM124856'   
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))
BDBM124856
PNG
(US8759386, 53)
Show SMILES CCCCn1c(cc2ccccc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)c(F)c1
Show InChI InChI=1S/C27H29FN4O3/c1-4-5-12-31-24-9-7-6-8-19(24)13-25(31)27(35)29-21-11-10-20(23(28)14-21)16-32-18(3)22(15-26(33)34)17(2)30-32/h6-11,13-14H,4-5,12,15-16H2,1-3H3,(H,29,35)(H,33,34)
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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