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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'DNA-dependent protein kinase catalytic subunit' and Ligand = 'BDBM179322'   
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
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM179322
PNG
(US9126952, 25)
Show SMILES Clc1nc(N2CCCC(Cn3ccnc3)C2)c2ccc(cc2n1)N1CCOCC1
Show InChI InChI=1S/C21H25ClN6O/c22-21-24-19-12-17(27-8-10-29-11-9-27)3-4-18(19)20(25-21)28-6-1-2-16(14-28)13-26-7-5-23-15-26/h3-5,7,12,15-16H,1-2,6,8-11,13-14H2
PDB

KEGG

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PC cid
PC sid
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Similars

US Patent
n/an/a<100n/an/an/an/a7.425



Merck Patent GmbH

US Patent


Assay Description
The kinase assay was carried out in streptavidin-coated 348-well microtitre FlashPlates®. To this end, 1.5 μg of the DNA-PK/protein complex and ...


US Patent US9126952 (2015)


BindingDB Entry DOI: 10.7270/Q2JH3JZ2
More data for this
Ligand-Target Pair