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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D' and Ligand = 'BDBM50217552'   
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/4B/4C/4D


(Homo sapiens (Human))
BDBM50217552
PNG
(CHEMBL339408)
Show SMILES Cc1cc2CCN3c2c(c1)C(=N[C@@H](NC(=O)c1cc2ccccc2cn1)C3=O)c1ccccc1 |c:12|
Show InChI InChI=1S/C28H22N4O2/c1-17-13-20-11-12-32-25(20)22(14-17)24(18-7-3-2-4-8-18)30-26(28(32)34)31-27(33)23-15-19-9-5-6-10-21(19)16-29-23/h2-10,13-16,26H,11-12H2,1H3,(H,31,33)/t26-/m0/s1
PDB

UniProtKB/SwissProt

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PC cid
PC sid
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Article
PubMed
n/an/a 2.60E+3n/an/an/an/an/an/a



Pfizer Inc.

Curated by ChEMBL


Assay Description
Inhibition of phosphodiesterase type 4 isozyme (PDE4) from the U937 human cell line.


J Med Chem 43: 4850-67 (2000)


Article DOI: 10.1021/jm000315p
BindingDB Entry DOI: 10.7270/Q25M68FS
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50217552
PNG
(CHEMBL339408)
Show SMILES Cc1cc2CCN3c2c(c1)C(=N[C@@H](NC(=O)c1cc2ccccc2cn1)C3=O)c1ccccc1 |c:12|
Show InChI InChI=1S/C28H22N4O2/c1-17-13-20-11-12-32-25(20)22(14-17)24(18-7-3-2-4-8-18)30-26(28(32)34)31-27(33)23-15-19-9-5-6-10-21(19)16-29-23/h2-10,13-16,26H,11-12H2,1H3,(H,31,33)/t26-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
antibodypedia
antibodypedia
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 2.60E+3n/an/an/an/an/an/a



Institut de Recherche Jouveinal-Parke Davis

Curated by ChEMBL


Assay Description
Inhibition of phosphodiesterase 4 extracted from human U937 cells by using radioligands [3H]-cAMP or [3H]cGMP.


Bioorg Med Chem Lett 10: 35-8 (2000)


BindingDB Entry DOI: 10.7270/Q25Q4Z9J
More data for this
Ligand-Target Pair