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BDBM179332 US9126952, 35

SMILES: C(C1CCCN(C1)c1ncnc2cc(ccc12)N1CCOCC1)c1cc2ccccc2s1

InChI Key: InChIKey=RAUFNYDOHVPKJZ-UHFFFAOYSA-N

Data: 1 IC50

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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 = 179332   
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
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM179332
PNG
(US9126952, 35)
Show SMILES C(C1CCCN(C1)c1ncnc2cc(ccc12)N1CCOCC1)c1cc2ccccc2s1
Show InChI InChI=1S/C26H28N4OS/c1-2-6-25-20(5-1)15-22(32-25)14-19-4-3-9-30(17-19)26-23-8-7-21(16-24(23)27-18-28-26)29-10-12-31-13-11-29/h1-2,5-8,15-16,18-19H,3-4,9-14,17H2
PDB

KEGG

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PC cid
PC sid
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Similars

US Patent
n/an/a 300n/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