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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'cAMP-specific 3',5'-cyclic phosphodiesterase 4A' and Ligand = 'BDBM50125075'   
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
cAMP-specific 3',5'-cyclic phosphodiesterase 4A


(Homo sapiens (Human))
BDBM50125075
PNG
(4-[2-[3,4-di(difluoromethoxy)phenyl]-2-(6-tetrahyd...)
Show SMILES [O-][n+]1ccc(CC(c2ccc(nc2)N2CCCC2)c2ccc(OC(F)F)c(OC(F)F)c2)cc1
Show InChI InChI=1S/C24H23F4N3O3/c25-23(26)33-20-5-3-17(14-21(20)34-24(27)28)19(13-16-7-11-31(32)12-8-16)18-4-6-22(29-15-18)30-9-1-2-10-30/h3-8,11-12,14-15,19,23-24H,1-2,9-10,13H2
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KEGG

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PC cid
PC sid
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Similars

PubMed
n/an/a 31n/an/an/an/an/an/a



Merck Frosst Centre for Therapeutic Research

Curated by ChEMBL


Assay Description
Inhibitory activity against human PDE4A expressed isoform using construct representing the common region of spliced variants as GST-fusion protein in...


Bioorg Med Chem Lett 13: 741-4 (2003)


BindingDB Entry DOI: 10.7270/Q2PG1R3G
More data for this
Ligand-Target Pair