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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 = 'BDBM165390'   
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))
BDBM165390
PNG
(US8168651, Compound TABLE 16.58 | US9062043, Table...)
Show SMILES OC(=O)c1ccc2c(c1)nc(Nc1cccc(c1)C(F)(F)F)c1ncncc21
Show InChI InChI=1S/C19H11F3N4O2/c20-19(21,22)11-2-1-3-12(7-11)25-17-16-14(8-23-9-24-16)13-5-4-10(18(27)28)6-15(13)26-17/h1-9H,(H,25,26)(H,27,28)
PDB

UniProtKB/SwissProt

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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
Casein kinase II subunit alpha


(Homo sapiens (Human))
BDBM165390
PNG
(US8168651, Compound TABLE 16.58 | US9062043, Table...)
Show SMILES OC(=O)c1ccc2c(c1)nc(Nc1cccc(c1)C(F)(F)F)c1ncncc21
Show InChI InChI=1S/C19H11F3N4O2/c20-19(21,22)11-2-1-3-12(7-11)25-17-16-14(8-23-9-24-16)13-5-4-10(18(27)28)6-15(13)26-17/h1-9H,(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))
BDBM165390
PNG
(US8168651, Compound TABLE 16.58 | US9062043, Table...)
Show SMILES OC(=O)c1ccc2c(c1)nc(Nc1cccc(c1)C(F)(F)F)c1ncncc21
Show InChI InChI=1S/C19H11F3N4O2/c20-19(21,22)11-2-1-3-12(7-11)25-17-16-14(8-23-9-24-16)13-5-4-10(18(27)28)6-15(13)26-17/h1-9H,(H,25,26)(H,27,28)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
n/an/a 98n/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