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BDBM220059 US9303033, C48, Table 58A, Compound 26::US9303033, I49, Table 59A, Compound 19

SMILES: Nc1cc(Nc2cc(Cl)ccc2F)nc2c(\C=C3/NC(=O)NC3=O)cnn12

InChI Key: InChIKey=LGEPKJARNKBUNX-JYOAFUTRSA-N

Data: 3 IC50

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 3 hits for monomerid = 220059   
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 (CK2 beta)


(Homo sapiens (Human))
BDBM220059
PNG
(US9303033, C48, Table 58A, Compound 26 | US9303033...)
Show SMILES Nc1cc(Nc2cc(Cl)ccc2F)nc2c(\C=C3/NC(=O)NC3=O)cnn12
Show InChI InChI=1S/C16H11ClFN7O2/c17-8-1-2-9(18)10(4-8)21-13-5-12(19)25-14(23-13)7(6-20-25)3-11-15(26)24-16(27)22-11/h1-6H,19H2,(H,21,23)(H2,22,24,26,27)/b11-3-
PDB

UniProtKB/SwissProt
UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 8.08E+4n/an/an/an/a7.0n/a



SENHWA BIOSCIENCES, INC.

US Patent


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


US Patent US9303033 (2016)


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


(Homo sapiens (Human)-Rattus norvegicus)
BDBM220059
PNG
(US9303033, C48, Table 58A, Compound 26 | US9303033...)
Show SMILES Nc1cc(Nc2cc(Cl)ccc2F)nc2c(\C=C3/NC(=O)NC3=O)cnn12
Show InChI InChI=1S/C16H11ClFN7O2/c17-8-1-2-9(18)10(4-8)21-13-5-12(19)25-14(23-13)7(6-20-25)3-11-15(26)24-16(27)22-11/h1-6H,19H2,(H,21,23)(H2,22,24,26,27)/b11-3-
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/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
Casein kinase II alpha/beta


(Homo sapiens (Human)-Rattus norvegicus)
BDBM220059
PNG
(US9303033, C48, Table 58A, Compound 26 | US9303033...)
Show SMILES Nc1cc(Nc2cc(Cl)ccc2F)nc2c(\C=C3/NC(=O)NC3=O)cnn12
Show InChI InChI=1S/C16H11ClFN7O2/c17-8-1-2-9(18)10(4-8)21-13-5-12(19)25-14(23-13)7(6-20-25)3-11-15(26)24-16(27)22-11/h1-6H,19H2,(H,21,23)(H2,22,24,26,27)/b11-3-
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a<10n/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