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Compile Data Set for Download or QSAR

Found 83 hits Enz. Inhib. hit(s) with all data for assayid = 12 entry = 50015678   
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))
BDBM50156498
PNG
(2-(2-Methyl-morpholin-4-yl)-benzo[h]chromen-4-one ...)
Show SMILES CC1CN(CCO1)c1cc(=O)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C18H17NO3/c1-12-11-19(8-9-21-12)17-10-16(20)15-7-6-13-4-2-3-5-14(13)18(15)22-17/h2-7,10,12H,8-9,11H2,1H3
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n/an/a 190n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50098126
PNG
(2-(morpholin-4-yl)-benzo[h]chromen-4-one | 2-Morph...)
Show SMILES O=c1cc(oc2c3ccccc3ccc12)N1CCOCC1
Show InChI InChI=1S/C17H15NO3/c19-15-11-16(18-7-9-20-10-8-18)21-17-13-4-2-1-3-12(13)5-6-14(15)17/h1-6,11H,7-10H2
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n/an/a 230n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159677
PNG
(2-Morpholin-4-yl-benzo[h]chromene-4-thione | CHEMB...)
Show SMILES S=c1cc(oc2c3ccccc3ccc12)N1CCOCC1
Show InChI InChI=1S/C17H15NO2S/c21-15-11-16(18-7-9-19-10-8-18)20-17-13-4-2-1-3-12(13)5-6-14(15)17/h1-6,11H,7-10H2
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n/an/a 260n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159620
PNG
(2-Morpholin-4-yl-pyrimido[2,1-a]isoquinolin-4-one ...)
Show SMILES O=c1cc(nc2c3ccccc3ccn12)N1CCOCC1
Show InChI InChI=1S/C16H15N3O2/c20-15-11-14(18-7-9-21-10-8-18)17-16-13-4-2-1-3-12(13)5-6-19(15)16/h1-6,11H,7-10H2
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n/an/a 280n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159621
PNG
(2-Morpholin-4-yl-7,8,9,10-tetrahydro-benzo[h]chrom...)
Show SMILES O=c1cc(oc2c3CCCCc3ccc12)N1CCOCC1
Show InChI InChI=1S/C17H19NO3/c19-15-11-16(18-7-9-20-10-8-18)21-17-13-4-2-1-3-12(13)5-6-14(15)17/h5-6,11H,1-4,7-10H2
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n/an/a 360n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159668
PNG
(2-Morpholin-4-yl-benzo[g]chromen-4-one | 2-morphol...)
Show SMILES O=c1cc(oc2cc3ccccc3cc12)N1CCOCC1
Show InChI InChI=1S/C17H15NO3/c19-15-11-17(18-5-7-20-8-6-18)21-16-10-13-4-2-1-3-12(13)9-14(15)16/h1-4,9-11H,5-8H2
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n/an/a 390n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159634
PNG
(7-Methoxy-2-morpholin-4-yl-chromen-4-one | CHEMBL1...)
Show SMILES COc1ccc2c(c1)oc(cc2=O)N1CCOCC1
Show InChI InChI=1S/C14H15NO4/c1-17-10-2-3-11-12(16)9-14(19-13(11)8-10)15-4-6-18-7-5-15/h2-3,8-9H,4-7H2,1H3
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n/an/a 950n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159658
PNG
(8-Methoxy-2-morpholin-4-yl-chromen-4-one | 8-metho...)
Show SMILES COc1cccc2c1oc(cc2=O)N1CCOCC1
Show InChI InChI=1S/C14H15NO4/c1-17-12-4-2-3-10-11(16)9-13(19-14(10)12)15-5-7-18-8-6-15/h2-4,9H,5-8H2,1H3
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n/an/a 1.20E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159678
PNG
(3-Morpholin-4-yl-benzo[f]chromen-1-one | 3-morphol...)
Show SMILES O=c1cc(oc2ccc3ccccc3c12)N1CCOCC1
Show InChI InChI=1S/C17H15NO3/c19-14-11-16(18-7-9-20-10-8-18)21-15-6-5-12-3-1-2-4-13(12)17(14)15/h1-6,11H,7-10H2
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n/an/a 1.25E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50098118
PNG
((2S,4R)-4-Mercapto-2-(2,4,5-trifluoro-benzyloxymet...)
Show SMILES O=c1cc(oc2ccccc12)N1CCOCC1
Show InChI InChI=1S/C13H13NO3/c15-11-9-13(14-5-7-16-8-6-14)17-12-4-2-1-3-10(11)12/h1-4,9H,5-8H2
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n/an/a 1.26E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159639
PNG
(2-Thiomorpholin-4-yl-benzo[h]chromen-4-one | 2-thi...)
Show SMILES O=c1cc(oc2c3ccccc3ccc12)N1CCSCC1
Show InChI InChI=1S/C17H15NO2S/c19-15-11-16(18-7-9-21-10-8-18)20-17-13-4-2-1-3-12(13)5-6-14(15)17/h1-6,11H,7-10H2
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n/an/a 1.38E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM12915
PNG
(2-(4-Morpholinyl)-8-phenyl-4H-1-benzopyran-4-one |...)
Show SMILES O=c1cc(oc2c(cccc12)-c1ccccc1)N1CCOCC1
Show InChI InChI=1S/C19H17NO3/c21-17-13-18(20-9-11-22-12-10-20)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2
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n/an/a 1.50E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159630
PNG
(8-Phenyl-2-thiomorpholin-4-yl-chromen-4-one | CHEM...)
Show SMILES O=c1cc(oc2c(cccc12)-c1ccccc1)N1CCSCC1
Show InChI InChI=1S/C19H17NO2S/c21-17-13-18(20-9-11-23-12-10-20)22-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2
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n/an/a 1.61E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159667
PNG
(8-Methyl-2-morpholin-4-yl-chromen-4-one | CHEMBL17...)
Show SMILES Cc1cccc2c1oc(cc2=O)N1CCOCC1
Show InChI InChI=1S/C14H15NO3/c1-10-3-2-4-11-12(16)9-13(18-14(10)11)15-5-7-17-8-6-15/h2-4,9H,5-8H2,1H3
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n/an/a 1.65E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159627
PNG
(2-Thiomorpholin-4-yl-pyrido[1,2-a]pyrimidin-4-one ...)
Show SMILES O=c1cc(nc2c3ccccc3ccn12)N1CCSCC1
Show InChI InChI=1S/C16H15N3OS/c20-15-11-14(18-7-9-21-10-8-18)17-16-13-4-2-1-3-12(13)5-6-19(15)16/h1-6,11H,7-10H2
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n/an/a 1.69E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159679
PNG
(6-Methoxy-4-morpholin-4-yl-chromen-2-one | 6-metho...)
Show SMILES COc1ccc2oc(=O)cc(N3CCOCC3)c2c1
Show InChI InChI=1S/C14H15NO4/c1-17-10-2-3-13-11(8-10)12(9-14(16)19-13)15-4-6-18-7-5-15/h2-3,8-9H,4-7H2,1H3
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n/an/a 1.75E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159603
PNG
(1-Morpholin-4-yl-benzo[f]chromen-3-one | CHEMBL178...)
Show SMILES O=c1cc(N2CCOCC2)c2c(ccc3ccccc23)o1
Show InChI InChI=1S/C17H15NO3/c19-16-11-14(18-7-9-20-10-8-18)17-13-4-2-1-3-12(13)5-6-15(17)21-16/h1-6,11H,7-10H2
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n/an/a 1.90E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159611
PNG
(2-Pyridin-3-yl-benzo[h]chromen-4-one | CHEMBL17793...)
Show SMILES O=c1cc(oc2c3ccccc3ccc12)-c1cccnc1
Show InChI InChI=1S/C18H11NO2/c20-16-10-17(13-5-3-9-19-11-13)21-18-14-6-2-1-4-12(14)7-8-15(16)18/h1-11H
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n/an/a 1.92E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159642
PNG
(2-Morpholin-4-yl-pyrido[1,2-a]pyrimidin-4-one | CH...)
Show SMILES O=c1cc(nc2ccccn12)N1CCOCC1
Show InChI InChI=1S/C12H13N3O2/c16-12-9-11(14-5-7-17-8-6-14)13-10-3-1-2-4-15(10)12/h1-4,9H,5-8H2
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n/an/a 2.00E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159676
PNG
(2-[1,4]Oxazepan-4-yl-benzo[h]chromen-4-one | CHEMB...)
Show SMILES O=c1cc(oc2c3ccccc3ccc12)N1CCCOCC1
Show InChI InChI=1S/C18H17NO3/c20-16-12-17(19-8-3-10-21-11-9-19)22-18-14-5-2-1-4-13(14)6-7-15(16)18/h1-2,4-7,12H,3,8-11H2
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n/an/a 2.01E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159661
PNG
(2-Morpholin-4-yl-6-phenyl-chromen-4-one | CHEMBL36...)
Show SMILES O=c1cc(oc2ccc(cc12)-c1ccccc1)N1CCOCC1
Show InChI InChI=1S/C19H17NO3/c21-17-13-19(20-8-10-22-11-9-20)23-18-7-6-15(12-16(17)18)14-4-2-1-3-5-14/h1-7,12-13H,8-11H2
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n/an/a 2.24E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159632
PNG
(2-(2,5-Dihydro-pyrrol-1-yl)-pyrimido[2,1-a]isoquin...)
Show SMILES O=c1cc(nc2c3ccccc3ccn12)N1CC=CC1 |c:20|
Show InChI InChI=1S/C16H13N3O/c20-15-11-14(18-8-3-4-9-18)17-16-13-6-2-1-5-12(13)7-10-19(15)16/h1-7,10-11H,8-9H2
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n/an/a 2.81E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159654
PNG
((1R,4R)-2-(2-Oxa-5-aza-bicyclo[2.2.1]hept-5-yl)-be...)
Show SMILES O=c1cc(oc2c3ccccc3ccc12)N1C[C@H]2C[C@@H]1CO2
Show InChI InChI=1S/C18H15NO3/c20-16-8-17(19-9-13-7-12(19)10-21-13)22-18-14-4-2-1-3-11(14)5-6-15(16)18/h1-6,8,12-13H,7,9-10H2/t12-,13-/m1/s1
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n/an/a 3.19E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159636
PNG
(4-Morpholin-4-yl-benzo[g]chromen-2-one | CHEMBL177...)
Show SMILES O=c1cc(N2CCOCC2)c2cc3ccccc3cc2o1
Show InChI InChI=1S/C17H15NO3/c19-17-11-15(18-5-7-20-8-6-18)14-9-12-3-1-2-4-13(12)10-16(14)21-17/h1-4,9-11H,5-8H2
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n/an/a 3.24E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159615
PNG
(2-((2S,6R)-2,6-Dimethyl-morpholin-4-yl)-pyrimido[2...)
Show SMILES C[C@H]1CN(C[C@@H](C)O1)c1cc(=O)n2ccc3ccccc3c2n1
Show InChI InChI=1S/C18H19N3O2/c1-12-10-20(11-13(2)23-12)16-9-17(22)21-8-7-14-5-3-4-6-15(14)18(21)19-16/h3-9,12-13H,10-11H2,1-2H3/t12-,13+
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n/an/a 3.25E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159672
PNG
(6-Chloro-4-morpholin-4-yl-chromen-2-one | CHEMBL17...)
Show SMILES Clc1ccc2oc(=O)cc(N3CCOCC3)c2c1
Show InChI InChI=1S/C13H12ClNO3/c14-9-1-2-12-10(7-9)11(8-13(16)18-12)15-3-5-17-6-4-15/h1-2,7-8H,3-6H2
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n/an/a 3.27E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159657
PNG
(2-(2,2-Dimethyl-morpholin-4-yl)-benzo[h]chromen-4-...)
Show SMILES CC1(C)CN(CCO1)c1cc(=O)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C19H19NO3/c1-19(2)12-20(9-10-22-19)17-11-16(21)15-8-7-13-5-3-4-6-14(13)18(15)23-17/h3-8,11H,9-10,12H2,1-2H3
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n/an/a 3.52E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159645
PNG
(2-(piperidin-1-yl)-4H-benzo[h]chromen-4-one | 2-Pi...)
Show SMILES O=c1cc(oc2c3ccccc3ccc12)N1CCCCC1
Show InChI InChI=1S/C18H17NO2/c20-16-12-17(19-10-4-1-5-11-19)21-18-14-7-3-2-6-13(14)8-9-15(16)18/h2-3,6-9,12H,1,4-5,10-11H2
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n/an/a 3.81E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159665
PNG
(2-(2,6-Dimethyl-morpholin-4-yl)-benzo[h]chromen-4-...)
Show SMILES CC1CN(CC(C)O1)c1cc(=O)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C19H19NO3/c1-12-10-20(11-13(2)22-12)18-9-17(21)16-8-7-14-5-3-4-6-15(14)19(16)23-18/h3-9,12-13H,10-11H2,1-2H3
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n/an/a 4.14E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159610
PNG
(8-Phenyl-2-piperidin-1-yl-chromen-4-one | CHEMBL17...)
Show SMILES O=c1cc(oc2c(cccc12)-c1ccccc1)N1CCCCC1
Show InChI InChI=1S/C20H19NO2/c22-18-14-19(21-12-5-2-6-13-21)23-20-16(10-7-11-17(18)20)15-8-3-1-4-9-15/h1,3-4,7-11,14H,2,5-6,12-13H2
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n/an/a 4.67E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159613
PNG
(4-Morpholin-4-yl-chromen-2-one | 4-morpholino-2H-c...)
Show SMILES O=c1cc(N2CCOCC2)c2ccccc2o1
Show InChI InChI=1S/C13H13NO3/c15-13-9-11(14-5-7-16-8-6-14)10-3-1-2-4-12(10)17-13/h1-4,9H,5-8H2
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n/an/a 4.82E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50014323
PNG
(2-PHENYL-4H-BENZO[H]CHROMEN-4-ONE | 2-Phenyl-benzo...)
Show SMILES O=c1cc(oc2c3ccccc3ccc12)-c1ccccc1
Show InChI InChI=1S/C19H12O2/c20-17-12-18(14-7-2-1-3-8-14)21-19-15-9-5-4-6-13(15)10-11-16(17)19/h1-12H
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n/an/a 4.98E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159602
PNG
(4-Thiomorpholin-4-yl-benzo[g]chromen-2-one | CHEMB...)
Show SMILES O=c1cc(N2CCSCC2)c2cc3ccccc3cc2o1
Show InChI InChI=1S/C17H15NO2S/c19-17-11-15(18-5-7-21-8-6-18)14-9-12-3-1-2-4-13(12)10-16(14)20-17/h1-4,9-11H,5-8H2
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n/an/a 5.15E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159606
PNG
(6-Methyl-4-morpholin-4-yl-chromen-2-one | 6-Methyl...)
Show SMILES Cc1ccc2oc(=O)cc(N3CCOCC3)c2c1
Show InChI InChI=1S/C14H15NO3/c1-10-2-3-13-11(8-10)12(9-14(16)18-13)15-4-6-17-7-5-15/h2-3,8-9H,4-7H2,1H3
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n/an/a 5.35E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159664
PNG
(4-(4-Oxo-8-phenyl-4H-chromen-2-yl)-1lambda*4*-thio...)
Show SMILES O=S1CCN(CC1)c1cc(=O)c2cccc(-c3ccccc3)c2o1
Show InChI InChI=1S/C19H17NO3S/c21-17-13-18(20-9-11-24(22)12-10-20)23-19-15(7-4-8-16(17)19)14-5-2-1-3-6-14/h1-8,13H,9-12H2
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n/an/a 5.71E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159673
PNG
(2-(3-Fluoro-phenyl)-benzo[h]chromen-4-one | CHEMBL...)
Show SMILES Fc1cccc(c1)-c1cc(=O)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C19H11FO2/c20-14-6-3-5-13(10-14)18-11-17(21)16-9-8-12-4-1-2-7-15(12)19(16)22-18/h1-11H
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n/an/a 5.71E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159631
PNG
(2-Pyrrolidin-1-yl-benzo[h]chromen-4-one | CHEMBL17...)
Show SMILES O=c1cc(oc2c3ccccc3ccc12)N1CCCC1
Show InChI InChI=1S/C17H15NO2/c19-15-11-16(18-9-3-4-10-18)20-17-13-6-2-1-5-12(13)7-8-14(15)17/h1-2,5-8,11H,3-4,9-10H2
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n/an/a 6.17E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159646
PNG
(2-((R)-3-Hydroxy-pyrrolidin-1-yl)-pyrimido[2,1-a]i...)
Show SMILES O[C@@H]1CCN(C1)c1cc(=O)n2ccc3ccccc3c2n1
Show InChI InChI=1S/C16H15N3O2/c20-12-6-7-18(10-12)14-9-15(21)19-8-5-11-3-1-2-4-13(11)16(19)17-14/h1-5,8-9,12,20H,6-7,10H2/t12-/m1/s1
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n/an/a 6.49E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159617
PNG
(4-Morpholin-4-yl-benzo[h]chromen-2-one | 4-Morphol...)
Show SMILES O=c1cc(N2CCOCC2)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C17H15NO3/c19-16-11-15(18-7-9-20-10-8-18)14-6-5-12-3-1-2-4-13(12)17(14)21-16/h1-6,11H,7-10H2
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n/an/a 6.66E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159674
PNG
(2-Pyrrolidin-1-yl-pyrimido[2,1-a]isoquinolin-4-one...)
Show SMILES O=c1cc(nc2c3ccccc3ccn12)N1CCCC1
Show InChI InChI=1S/C16H15N3O/c20-15-11-14(18-8-3-4-9-18)17-16-13-6-2-1-5-12(13)7-10-19(15)16/h1-2,5-7,10-11H,3-4,8-9H2
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n/an/a 6.68E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159675
PNG
(2-(2,2-Dimethyl-morpholin-4-yl)-pyrimido[2,1-a]iso...)
Show SMILES CC1(C)CN(CCO1)c1cc(=O)n2ccc3ccccc3c2n1
Show InChI InChI=1S/C18H19N3O2/c1-18(2)12-20(9-10-23-18)15-11-16(22)21-8-7-13-5-3-4-6-14(13)17(21)19-15/h3-8,11H,9-10,12H2,1-2H3
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n/an/a 6.71E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159660
PNG
(2-(4-Amino-phenyl)-benzo[h]chromen-4-one | CHEMBL1...)
Show SMILES Nc1ccc(cc1)-c1cc(=O)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C19H13NO2/c20-14-8-5-13(6-9-14)18-11-17(21)16-10-7-12-3-1-2-4-15(12)19(16)22-18/h1-11H,20H2
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n/an/a 7.70E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159649
PNG
(8-Methyl-4-morpholin-4-yl-chromen-2-one | CHEMBL36...)
Show SMILES Cc1cccc2c(cc(=O)oc12)N1CCOCC1
Show InChI InChI=1S/C14H15NO3/c1-10-3-2-4-11-12(9-13(16)18-14(10)11)15-5-7-17-8-6-15/h2-4,9H,5-8H2,1H3
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n/an/a 8.05E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159644
PNG
(2-(2,3-Dihydroxy-propylamino)-pyrimido[2,1-a]isoqu...)
Show SMILES OCC(O)CNc1cc(=O)n2ccc3ccccc3c2n1
Show InChI InChI=1S/C15H15N3O3/c19-9-11(20)8-16-13-7-14(21)18-6-5-10-3-1-2-4-12(10)15(18)17-13/h1-7,11,16,19-20H,8-9H2
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n/an/a 8.46E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159614
PNG
(2-(2-Fluoro-phenyl)-benzo[h]chromen-4-one | CHEMBL...)
Show SMILES Fc1ccccc1-c1cc(=O)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C19H11FO2/c20-16-8-4-3-7-14(16)18-11-17(21)15-10-9-12-5-1-2-6-13(12)19(15)22-18/h1-11H
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n/an/a 8.59E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159626
PNG
(4-Piperidin-1-yl-chromen-2-one | CHEMBL176114)
Show SMILES O=c1cc(N2CCCCC2)c2ccccc2o1
Show InChI InChI=1S/C14H15NO2/c16-14-10-12(15-8-4-1-5-9-15)11-6-2-3-7-13(11)17-14/h2-3,6-7,10H,1,4-5,8-9H2
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n/an/a 8.81E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159625
PNG
(2-(3-Hydroxy-pyrrolidin-1-yl)-benzo[h]chromen-4-on...)
Show SMILES OC1CCN(C1)c1cc(=O)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C17H15NO3/c19-12-7-8-18(10-12)16-9-15(20)14-6-5-11-3-1-2-4-13(11)17(14)21-16/h1-6,9,12,19H,7-8,10H2
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n/an/a 9.27E+3n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159637
PNG
(2-(2-Ethyl-morpholin-4-yl)-pyrimido[2,1-a]isoquino...)
Show SMILES CCC1CN(CCO1)c1cc(=O)n2ccc3ccccc3c2n1
Show InChI InChI=1S/C18H19N3O2/c1-2-14-12-20(9-10-23-14)16-11-17(22)21-8-7-13-5-3-4-6-15(13)18(21)19-16/h3-8,11,14H,2,9-10,12H2,1H3
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n/an/a>1.00E+4n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159643
PNG
(2-(2-Hydroxymethyl-morpholin-4-yl)-pyrimido[2,1-a]...)
Show SMILES OCC1CN(CCO1)c1cc(=O)n2ccc3ccccc3c2n1
Show InChI InChI=1S/C17H17N3O3/c21-11-13-10-19(7-8-23-13)15-9-16(22)20-6-5-12-3-1-2-4-14(12)17(20)18-15/h1-6,9,13,21H,7-8,10-11H2
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n/an/a>1.00E+4n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit


(Homo sapiens (Human))
BDBM50159671
PNG
(2-[2-(2-Bromo-phenoxy)-ethylamino]-benzo[h]chromen...)
Show SMILES Brc1ccccc1OCCNc1cc(=O)c2ccc3ccccc3c2o1
Show InChI InChI=1S/C21H16BrNO3/c22-17-7-3-4-8-19(17)25-12-11-23-20-13-18(24)16-10-9-14-5-1-2-6-15(14)21(16)26-20/h1-10,13,23H,11-12H2
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Article
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n/an/a>1.00E+4n/an/an/an/an/an/a



The University

Curated by ChEMBL


Assay Description
Inhibition of DNA dependent protein kinase isolated from HeLa cells


J Med Chem 48: 569-85 (2005)


Article DOI: 10.1021/jm049526a
BindingDB Entry DOI: 10.7270/Q2BK1BV9
More data for this
Ligand-Target Pair
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