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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Casein kinase II subunit alpha' and Ligand = 'BDBM165421'   
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
Casein kinase II subunit alpha


(Homo sapiens (Human))
BDBM165421
PNG
(US8168651, Compound TABLE 16.89 | US9062043, Table...)
Show SMILES OC(=O)c1ccc2c(c1)nc(Nc1cccc(c1)C(F)(F)F)c1ccncc21
Show InChI InChI=1S/C20H12F3N3O2/c21-20(22,23)12-2-1-3-13(9-12)25-18-15-6-7-24-10-16(15)14-5-4-11(19(27)28)8-17(14)26-18/h1-10H,(H,25,26)(H,27,28)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

n/an/a 11n/an/an/an/an/an/a


TBA



Citation and Details

BindingDB Entry DOI: 10.7270/Q21N857Q
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha


(Homo sapiens (Human))
BDBM165421
PNG
(US8168651, Compound TABLE 16.89 | US9062043, Table...)
Show SMILES OC(=O)c1ccc2c(c1)nc(Nc1cccc(c1)C(F)(F)F)c1ccncc21
Show InChI InChI=1S/C20H12F3N3O2/c21-20(22,23)12-2-1-3-13(9-12)25-18-15-6-7-24-10-16(15)14-5-4-11(19(27)28)8-17(14)26-18/h1-10H,(H,25,26)(H,27,28)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 11n/an/an/an/a7.2n/a



SENHWA BIOSCIENCES, INC.

US Patent


Assay Description
Test compounds in aqueous solution were added at a volume of 10 microliters, to a reaction mixture comprising 10 microliters Assay Dilution Buffer (A...


US Patent US9062043 (2015)


BindingDB Entry DOI: 10.7270/Q20G3HWF
More data for this
Ligand-Target Pair