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SMILES: CCN(CC)CCCC(C)NC(=O)c1ccc(s1)-c1cc(NC2CC2)n2ncc(\C=C3/NC(=O)NC3=O)c2n1

InChI Key: InChIKey=ZISSHDAZTPBUDE-MOSHPQCFSA-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 = 219136   
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))
BDBM219136
PNG
(US9303033, G12, Table 23A, Compound 93)
Show SMILES CCN(CC)CCCC(C)NC(=O)c1ccc(s1)-c1cc(NC2CC2)n2ncc(\C=C3/NC(=O)NC3=O)c2n1
Show InChI InChI=1S/C27H34N8O3S/c1-4-34(5-2)12-6-7-16(3)29-26(37)22-11-10-21(39-22)19-14-23(30-18-8-9-18)35-24(31-19)17(15-28-35)13-20-25(36)33-27(38)32-20/h10-11,13-16,18,30H,4-9,12H2,1-3H3,(H,29,37)(H2,32,33,36,38)/b20-13-
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
US Patent
n/an/a 811n/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)
BDBM219136
PNG
(US9303033, G12, Table 23A, Compound 93)
Show SMILES CCN(CC)CCCC(C)NC(=O)c1ccc(s1)-c1cc(NC2CC2)n2ncc(\C=C3/NC(=O)NC3=O)c2n1
Show InChI InChI=1S/C27H34N8O3S/c1-4-34(5-2)12-6-7-16(3)29-26(37)22-11-10-21(39-22)19-14-23(30-18-8-9-18)35-24(31-19)17(15-28-35)13-20-25(36)33-27(38)32-20/h10-11,13-16,18,30H,4-9,12H2,1-3H3,(H,29,37)(H2,32,33,36,38)/b20-13-
PDB

KEGG

UniProtKB/SwissProt

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