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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 = 'BDBM124832'   
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))
BDBM124832
PNG
(US8759386, 29)
Show SMILES CCn1c(cc2ccc(F)cc12)C(=O)Nc1ccc(Cn2nc(C)c(CC(O)=O)c2C)cc1
Show InChI InChI=1S/C25H25FN4O3/c1-4-29-22-12-19(26)8-7-18(22)11-23(29)25(33)27-20-9-5-17(6-10-20)14-30-16(3)21(13-24(31)32)15(2)28-30/h5-12H,4,13-14H2,1-3H3,(H,27,33)(H,31,32)
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PC cid
PC sid
UniChem
US Patent
0.100 -57.1n/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