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SMILES: Clc1cccc(Nc2cc(NC3CCNC3)n3ncc(\C=C4/NC(=O)NC4=O)c3n2)c1

InChI Key: InChIKey=OWPDNCRGIFXISG-UUASQNMZSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 218988   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Casein kinase II subunit beta


(Homo sapiens (Human))
BDBM218988
PNG
(US9303033, P6, Table 19A, Compound 15)
Show SMILES Clc1cccc(Nc2cc(NC3CCNC3)n3ncc(\C=C4/NC(=O)NC4=O)c3n2)c1
Show InChI InChI=1S/C20H19ClN8O2/c21-12-2-1-3-13(7-12)24-16-8-17(25-14-4-5-22-10-14)29-18(27-16)11(9-23-29)6-15-19(30)28-20(31)26-15/h1-3,6-9,14,22,25H,4-5,10H2,(H,24,27)(H2,26,28,30,31)/b15-6-
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 701n/an/an/an/a7.0n/a



SENHWA BIOSCIENCES, INC.

US Patent


Assay Description
5 uM ATP: Test compounds dissolved and diluted in DMSO (2 μl) were added to a reaction mixture comprising 10 μl of 5× Reaction Buffer (40 m...


US Patent US9303033 (2016)


BindingDB Entry DOI: 10.7270/Q2CN72RX
More data for this
Ligand-Target Pair
Casein kinase II subunit alpha/beta


(Homo sapiens (Human)-Rattus norvegicus)
BDBM218988
PNG
(US9303033, P6, Table 19A, Compound 15)
Show SMILES Clc1cccc(Nc2cc(NC3CCNC3)n3ncc(\C=C4/NC(=O)NC4=O)c3n2)c1
Show InChI InChI=1S/C20H19ClN8O2/c21-12-2-1-3-13(7-12)24-16-8-17(25-14-4-5-22-10-14)29-18(27-16)11(9-23-29)6-15-19(30)28-20(31)26-15/h1-3,6-9,14,22,25H,4-5,10H2,(H,24,27)(H2,26,28,30,31)/b15-6-
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<1.00E+3n/an/an/an/a7.2n/a



SENHWA BIOSCIENCES, INC.

US Patent


Assay Description
In a final reaction volume of 50 μl, CK2 ααββ (4 ng, 8.5 mU) was incubated with various concentrations of test compounds in ...


US Patent US9303033 (2016)


BindingDB Entry DOI: 10.7270/Q2CN72RX
More data for this
Ligand-Target Pair