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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 = 'BDBM50221015'   
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))
BDBM50221015
PNG
(CHEMBL310612)
Show SMILES CCc1nnc(Cc2c(Cl)cncc2Cl)c2cc(OC3CCCC3)c(OC)cc12
Show InChI InChI=1S/C22H23Cl2N3O2/c1-3-19-14-9-21(28-2)22(29-13-6-4-5-7-13)10-15(14)20(27-26-19)8-16-17(23)11-25-12-18(16)24/h9-13H,3-8H2,1-2H3
PDB

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 75n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
In vitro inhibitory concentration against phosphodiesterase 4.


Bioorg Med Chem Lett 13: 2473-9 (2003)


BindingDB Entry DOI: 10.7270/Q24F1SXB
More data for this
Ligand-Target Pair
cAMP-specific 3',5'-cyclic phosphodiesterase 4A/4B/4C/4D


(Homo sapiens (Human))
BDBM50221015
PNG
(CHEMBL310612)
Show SMILES CCc1nnc(Cc2c(Cl)cncc2Cl)c2cc(OC3CCCC3)c(OC)cc12
Show InChI InChI=1S/C22H23Cl2N3O2/c1-3-19-14-9-21(28-2)22(29-13-6-4-5-7-13)10-15(14)20(27-26-19)8-16-17(23)11-25-12-18(16)24/h9-13H,3-8H2,1-2H3
PDB

UniProtKB/SwissProt

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

Similars

PubMed
n/an/a 76n/an/an/an/an/an/a



National Institute of Pharmaceutical Education and Research

Curated by ChEMBL


Assay Description
Inhibitory concentration against phosphodiesterase 4.


Bioorg Med Chem Lett 13: 2473-9 (2003)


BindingDB Entry DOI: 10.7270/Q24F1SXB
More data for this
Ligand-Target Pair