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SMILES: O=C(Nc1cc(NC2CC2)n2ncc(\C=C3/NC(=O)NC3=O)c2n1)OCc1ccccc1

InChI Key: InChIKey=KPUTXZVYTZLRPG-NVNXTCNLSA-N

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 220037   
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 alpha/beta


(Homo sapiens (Human)-Rattus norvegicus)		BDBM220037
PNG
(US9303033, G47, Table 58A, Compound 4)
Show SMILES O=C(Nc1cc(NC2CC2)n2ncc(\C=C3/NC(=O)NC3=O)c2n1)OCc1ccccc1
Show InChI InChI=1S/C21H19N7O4/c29-19-15(24-20(30)27-19)8-13-10-22-28-17(23-14-6-7-14)9-16(25-18(13)28)26-21(31)32-11-12-4-2-1-3-5-12/h1-5,8-10,14,23H,6-7,11H2,(H,25,26,31)(H2,24,27,29,30)/b15-8-
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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