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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Calcium/calmodulin-dependent protein kinase type II subunit delta' and Ligand = 'BDBM292486'   
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
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))
BDBM292486
PNG
((S)-2-(3-cyanoazetidin-1-yl)-N-(2-(diethylamino)pr...)
Show SMILES CCN(CC)[C@@H](C)CNC(=O)c1cc(nc(c1)-c1cnn2ccc(nc12)-c1cccs1)N1CC(C1)C#N |r|
Show InChI InChI=1S/C27H30N8OS/c1-4-33(5-2)18(3)14-29-27(36)20-11-23(31-25(12-20)34-16-19(13-28)17-34)21-15-30-35-9-8-22(32-26(21)35)24-7-6-10-37-24/h6-12,15,18-19H,4-5,14,16-17H2,1-3H3,(H,29,36)/t18-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 0.100n/an/an/an/an/an/a



Gilead Sciences, Inc.

US Patent


Assay Description
The biochemical activity of recombinant CaMKIIδ was measured by monitoring the phosphorylation of a target peptide using Homogenous Time Resolve...


US Patent US10100058 (2018)


BindingDB Entry DOI: 10.7270/Q2V98B4F
More data for this
Ligand-Target Pair
Calcium/calmodulin-dependent protein kinase type II subunit delta


(Homo sapiens (Human))
BDBM292486
PNG
((S)-2-(3-cyanoazetidin-1-yl)-N-(2-(diethylamino)pr...)
Show SMILES CCN(CC)[C@@H](C)CNC(=O)c1cc(nc(c1)-c1cnn2ccc(nc12)-c1cccs1)N1CC(C1)C#N |r|
Show InChI InChI=1S/C27H30N8OS/c1-4-33(5-2)18(3)14-29-27(36)20-11-23(31-25(12-20)34-16-19(13-28)17-34)21-15-30-35-9-8-22(32-26(21)35)24-7-6-10-37-24/h6-12,15,18-19H,4-5,14,16-17H2,1-3H3,(H,29,36)/t18-/m0/s1
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/an/an/a 9.07n/an/an/an/a



Gilead Sciences, Inc.

US Patent


Assay Description
CaMKII activity in neonatal rat ventricular myocytes (NRVM) was measured by monitoring the phosphorylation level of phospholamban using high-content ...


US Patent US10100058 (2018)


BindingDB Entry DOI: 10.7270/Q2V98B4F
More data for this
Ligand-Target Pair