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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 = 'BDBM50345749'   
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


()
BDBM50345749
PNG
(3-(3-(benzyloxy)phenyl)-1-isopropyl-1H-pyrazolo[3,...)
Show SMILES CC(C)n1nc(-c2cccc(OCc3ccccc3)c2)c2c(N)ncnc12
Show InChI InChI=1S/C21H21N5O/c1-14(2)26-21-18(20(22)23-13-24-21)19(25-26)16-9-6-10-17(11-16)27-12-15-7-4-3-5-8-15/h3-11,13-14H,12H2,1-2H3,(H2,22,23,24)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.06E+3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of TgCDPK1 and CpCDPK1 was determined using a luminescent kinase assay which measures ATP depletion in the presence of the Syntide 2 pepti...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077GQ
More data for this
Ligand-Target Pair
cGMP-dependent protein kinase


()
BDBM50345749
PNG
(3-(3-(benzyloxy)phenyl)-1-isopropyl-1H-pyrazolo[3,...)
Show SMILES CC(C)n1nc(-c2cccc(OCc3ccccc3)c2)c2c(N)ncnc12
Show InChI InChI=1S/C21H21N5O/c1-14(2)26-21-18(20(22)23-13-24-21)19(25-26)16-9-6-10-17(11-16)27-12-15-7-4-3-5-8-15/h3-11,13-14H,12H2,1-2H3,(H2,22,23,24)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 1.10E+3n/an/an/an/an/an/a


TBA

Assay Description
Kinase phosphorylation reactions were performed in a buffered medium containing 20 mM HEPES pH 7.5 (KOH), 0.1% BSA, 10 mM MgCl2, 1 mM EGTA (pH 7.2), ...


Citation and Details

BindingDB Entry DOI: 10.7270/Q2K077GQ
More data for this
Ligand-Target Pair