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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'cGMP-dependent protein kinase' and Ligand = 'BDBM50168204'   
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
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50168204
PNG
(4-[2-(4-Fluoro-phenyl)-5-(1-propyl-piperidin-4-yl)...)
Show SMILES CCCN1CCC(CC1)c1cc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C23H26FN3/c1-2-13-27-14-9-18(10-15-27)22-16-21(17-7-11-25-12-8-17)23(26-22)19-3-5-20(24)6-4-19/h3-8,11-12,16,18,26H,2,9-10,13-15H2,1H3
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.20n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
In vitro inhibition of Eimeria tenella cGMP-dependent protein kinase


Bioorg Med Chem Lett 15: 3296-301 (2005)


Article DOI: 10.1016/j.bmcl.2005.04.060
BindingDB Entry DOI: 10.7270/Q24M9421
More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


(Eimeria tenella)
BDBM50168204
PNG
(4-[2-(4-Fluoro-phenyl)-5-(1-propyl-piperidin-4-yl)...)
Show SMILES CCCN1CCC(CC1)c1cc(c([nH]1)-c1ccc(F)cc1)-c1ccncc1
Show InChI InChI=1S/C23H26FN3/c1-2-13-27-14-9-18(10-15-27)22-16-21(17-7-11-25-12-8-17)23(26-22)19-3-5-20(24)6-4-19/h3-8,11-12,16,18,26H,2,9-10,13-15H2,1H3
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 4.20n/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Inhibitory activity against cGMP-dependent protein kinase from Eimeria tenella


Bioorg Med Chem Lett 15: 4570-3 (2005)


Article DOI: 10.1016/j.bmcl.2005.06.096
BindingDB Entry DOI: 10.7270/Q2416WM9
More data for this
Ligand-Target Pair