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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Casein kinase II subunit alpha' and Ligand = 'BDBM165397'   
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))
BDBM165397
PNG
(US8168651, Compound TABLE 16.65 | US9062043, Table...)
Show SMILES CCNc1ncc2c3ccc(cc3nc(Nc3cccc(Cl)c3)c2n1)C(O)=O
Show InChI InChI=1S/C20H16ClN5O2/c1-2-22-20-23-10-15-14-7-6-11(19(27)28)8-16(14)25-18(17(15)26-20)24-13-5-3-4-12(21)9-13/h3-10H,2H2,1H3,(H,24,25)(H,27,28)(H,22,23,26)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 10n/an/an/an/a7.4n/a



SENHWA BIOSCIENCES, INC.

US Patent


Assay Description
The human leukemia Jurkat T-cell line was maintained in RPMI 1640 (Cambrex) supplemented with 10% fetal calf serum and 50 ng/ml Geutamycin. Before tr...


US Patent US9062043 (2015)


BindingDB Entry DOI: 10.7270/Q20G3HWF
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha


(Homo sapiens (Human))
BDBM165397
PNG
(US8168651, Compound TABLE 16.65 | US9062043, Table...)
Show SMILES CCNc1ncc2c3ccc(cc3nc(Nc3cccc(Cl)c3)c2n1)C(O)=O
Show InChI InChI=1S/C20H16ClN5O2/c1-2-22-20-23-10-15-14-7-6-11(19(27)28)8-16(14)25-18(17(15)26-20)24-13-5-3-4-12(21)9-13/h3-10H,2H2,1H3,(H,24,25)(H,27,28)(H,22,23,26)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

n/an/a 30n/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))
BDBM165397
PNG
(US8168651, Compound TABLE 16.65 | US9062043, Table...)
Show SMILES CCNc1ncc2c3ccc(cc3nc(Nc3cccc(Cl)c3)c2n1)C(O)=O
Show InChI InChI=1S/C20H16ClN5O2/c1-2-22-20-23-10-15-14-7-6-11(19(27)28)8-16(14)25-18(17(15)26-20)24-13-5-3-4-12(21)9-13/h3-10H,2H2,1H3,(H,24,25)(H,27,28)(H,22,23,26)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 30n/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