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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 = 'BDBM50500325'   
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))
BDBM50500325
PNG
(Cb 5083 | Cb-5083)
Show SMILES Cc1cc2c(cccc2n1-c1nc2CCOCc2c(NCc2ccccc2)n1)C(N)=O
Show InChI InChI=1S/C24H23N5O2/c1-15-12-18-17(22(25)30)8-5-9-21(18)29(15)24-27-20-10-11-31-14-19(20)23(28-24)26-13-16-6-3-2-4-7-16/h2-9,12H,10-11,13-14H2,1H3,(H2,25,30)(H,26,27,28)
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KEGG

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MCE
PC cid
PC sid
PDB
UniChem
Article
PubMed
n/an/a 500n/an/an/an/an/an/a



Cleave Biosciences Inc.

Curated by ChEMBL


Assay Description
Inhibition of DNAPK (unknown origin)


J Med Chem 58: 9480-97 (2015)


Article DOI: 10.1021/acs.jmedchem.5b01346
BindingDB Entry DOI: 10.7270/Q2KW5K2P
More data for this
Ligand-Target Pair