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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'DNA-dependent protein kinase catalytic subunit' and Ligand = 'BDBM50245504'   
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))
BDBM50245504
PNG
(8-(biphenyl-3-yl)-2-morpholino-4H-chromen-4-one | ...)
Show SMILES O=c1cc(oc2c(cccc12)-c1cccc(c1)-c1ccccc1)N1CCOCC1
Show InChI InChI=1S/C25H21NO3/c27-23-17-24(26-12-14-28-15-13-26)29-25-21(10-5-11-22(23)25)20-9-4-8-19(16-20)18-6-2-1-3-7-18/h1-11,16-17H,12-15H2
PDB

KEGG

UniProtKB/SwissProt

DrugBank
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GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 180n/an/an/an/an/an/a



Newcastle University

Curated by ChEMBL


Assay Description
Inhibition of DNA-dependent protein kinase


Bioorg Med Chem Lett 18: 4885-90 (2008)


Article DOI: 10.1016/j.bmcl.2008.07.066
BindingDB Entry DOI: 10.7270/Q2J10305
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50245504
PNG
(8-(biphenyl-3-yl)-2-morpholino-4H-chromen-4-one | ...)
Show SMILES O=c1cc(oc2c(cccc12)-c1cccc(c1)-c1ccccc1)N1CCOCC1
Show InChI InChI=1S/C25H21NO3/c27-23-17-24(26-12-14-28-15-13-26)29-25-21(10-5-11-22(23)25)20-9-4-8-19(16-20)18-6-2-1-3-7-18/h1-11,16-17H,12-15H2
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 180n/an/an/an/an/an/a



Newcastle University

Curated by ChEMBL


Assay Description
Inhibition of DNA-dependent protein kinase


Bioorg Med Chem Lett 20: 3649-53 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.102
BindingDB Entry DOI: 10.7270/Q2R49QX1
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50245504
PNG
(8-(biphenyl-3-yl)-2-morpholino-4H-chromen-4-one | ...)
Show SMILES O=c1cc(oc2c(cccc12)-c1cccc(c1)-c1ccccc1)N1CCOCC1
Show InChI InChI=1S/C25H21NO3/c27-23-17-24(26-12-14-28-15-13-26)29-25-21(10-5-11-22(23)25)20-9-4-8-19(16-20)18-6-2-1-3-7-18/h1-11,16-17H,12-15H2
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 180n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of DNA-PK


Bioorg Med Chem Lett 22: 5352-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.053
BindingDB Entry DOI: 10.7270/Q23J3F2G
More data for this
Ligand-Target Pair