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Compile Data Set for Download or QSAR

Found 138 hits with Last Name = 'fischer' and Initial = 'f'   
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
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550658
PNG
(CHEMBL4792191)
Show SMILES Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1
PDB

UniProtKB/SwissProt

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n/an/a 0.5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550655
PNG
(CHEMBL4763842)
Show SMILES CC1(CNc2ccc3Sc4c(Cc3c2)cccc4-c2cc(=O)cc(o2)N2CCOCC2)COC1
PDB

UniProtKB/SwissProt

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n/an/a 0.5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550687
PNG
(CHEMBL4781601)
Show SMILES O=c1cc(oc(c1)-c1cccc2Cc3cc(OCC4CCOCC4)ccc3Sc12)N1CCOCC1
PDB

UniProtKB/SwissProt

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n/an/a 0.5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550659
PNG
(CHEMBL4763108)
Show SMILES [H][C@@]12CN(CCOc3ccc4Sc5c(Cc4c3)cccc5-c3cc(=O)cc(o3)N3CCOCC3)[C@@]([H])(CO1)C2 |r|
PDB

UniProtKB/SwissProt

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n/an/a 0.5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550666
PNG
(CHEMBL4788241)
Show SMILES C[C@H]1CN(CCOc2ccc3Sc4c(Cc3c2)cccc4-c2cc(=O)cc(o2)N2CCOCC2)C[C@@H](C)O1 |r|
PDB

UniProtKB/SwissProt

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n/an/a 0.5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550662
PNG
(CHEMBL4748079)
Show SMILES FC1(F)CCN(CCOc2ccc3Sc4c(Cc3c2)cccc4-c2cc(=O)cc(o2)N2CCOCC2)C1
PDB

UniProtKB/SwissProt

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n/an/a 0.5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550654
PNG
(CHEMBL4790714)
Show SMILES CC(=O)Nc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1
PDB

UniProtKB/SwissProt

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n/an/a 0.600n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550653
PNG
(CHEMBL4794627)
Show SMILES O=C(Nc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1)C1CC1
PDB

UniProtKB/SwissProt

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n/an/a 0.600n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550683
PNG
(CHEMBL4763102)
Show SMILES C[C@H](O)COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
PDB

UniProtKB/SwissProt

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n/an/a 0.600n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550673
PNG
(CHEMBL4745255)
Show SMILES C[C@H](CN1CCOCC1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
PDB

UniProtKB/SwissProt

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PDB
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n/an/a 0.600n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550663
PNG
(CHEMBL4786685)
Show SMILES FC1CN(CCOc2ccc3Sc4c(Cc3c2)cccc4-c2cc(=O)cc(o2)N2CCOCC2)C1
PDB

UniProtKB/SwissProt

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n/an/a 0.600n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550665
PNG
(CHEMBL4777914)
Show SMILES CN1CCN(CCOc2ccc3Sc4c(Cc3c2)cccc4-c2cc(=O)cc(o2)N2CCOCC2)CC1
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a 0.700n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550660
PNG
(CHEMBL4783324)
Show SMILES FC1(F)CCN(CCOc2ccc3Sc4c(Cc3c2)cccc4-c2cc(=O)cc(o2)N2CCOCC2)CC1
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a 0.700n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550676
PNG
(CHEMBL4784220)
Show SMILES C[C@@H](COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1)N1CCOCC1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a 0.700n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550674
PNG
(CHEMBL4742203)
Show SMILES C[C@@H](CN1CCOCC1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
PDB

UniProtKB/SwissProt

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n/an/a 1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550686
PNG
(CHEMBL4760480)
Show SMILES O=c1cc(oc(c1)-c1cccc2Cc3cc(OC4COC4)ccc3Sc12)N1CCOCC1
PDB

UniProtKB/SwissProt

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n/an/a 1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550681
PNG
(CHEMBL4761765)
Show SMILES C[C@H](COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1)N1C[C@H](C)O[C@H](C)C1 |r|
PDB

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TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550667
PNG
(CHEMBL4797110)
Show SMILES [H][C@@]12CN(C[C@H](C)Oc3ccc4Sc5c(Cc4c3)cccc5-c3cc(=O)cc(o3)N3CCOCC3)[C@@]([H])(CO1)C2 |r|
PDB

UniProtKB/SwissProt

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TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550675
PNG
(CHEMBL4797559)
Show SMILES C[C@H](COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1)N1CCOCC1 |r|
PDB

UniProtKB/SwissProt

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n/an/a 1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550671
PNG
(CHEMBL4751373)
Show SMILES C[C@@H](CN1CCOCC11COC1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
PDB

UniProtKB/SwissProt

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n/an/a 1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550684
PNG
(CHEMBL4752634)
Show SMILES COC[C@@H](C)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a 1n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550661
PNG
(CHEMBL4756577)
Show SMILES O=c1cc(oc(c1)-c1cccc2Cc3cc(OCCN4CCCC44CCOC4)ccc3Sc12)N1CCOCC1
PDB

UniProtKB/SwissProt

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n/an/a 1.40n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550670
PNG
(CHEMBL4759581)
Show SMILES C[C@@H](CN1CCOC2(CC2)C1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a 2n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550669
PNG
(CHEMBL4794132)
Show SMILES C[C@H](CN1C[C@H](C)O[C@H](C)C1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
PDB

UniProtKB/SwissProt

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TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550668
PNG
(CHEMBL4754219)
Show SMILES C[C@@H](CN1C[C@H](C)O[C@H](C)C1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
PDB

UniProtKB/SwissProt

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n/an/a 2n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550664
PNG
(CHEMBL4791332)
Show SMILES CC(C)(O)C1CCN(CCOc2ccc3Sc4c(Cc3c2)cccc4-c2cc(=O)cc(o2)N2CCOCC2)CC1
PDB

UniProtKB/SwissProt

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n/an/a 3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550677
PNG
(CHEMBL4788818)
Show SMILES CN1CC[C@H](C1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a 3n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550685
PNG
(CHEMBL4747809)
Show SMILES O=c1cc(oc(c1)-c1cccc2Cc3cc(OC4CCOCC4)ccc3Sc12)N1CCOCC1
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a 3.20n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550680
PNG
(CHEMBL4788662)
Show SMILES FC(F)CN1CC(C1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a 4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550682
PNG
(CHEMBL4760622)
Show SMILES CO[C@@H](C)COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
PDB

UniProtKB/SwissProt

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n/an/a 4n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550691
PNG
(CHEMBL4783046)
Show SMILES COC[C@H]1c2cc(OC)ccc2Sc2c1cccc2-c1cc(=O)cc(o1)N1CCOCC1 |r|
PDB

UniProtKB/SwissProt

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n/an/a 5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550657
PNG
(CHEMBL4792737)
Show SMILES COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1
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n/an/a 5n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50059640
PNG
(CHEMBL2140173)
Show SMILES C[C@H]1CN(CC(=O)Nc2ccc3Sc4c(Cc3c2)cccc4-c2cc(=O)cc(o2)N2CCOCC2)C[C@@H](C)O1
Show InChI InChI=1S/C30H33N3O5S/c1-19-16-32(17-20(2)37-19)18-28(35)31-23-6-7-27-22(13-23)12-21-4-3-5-25(30(21)39-27)26-14-24(34)15-29(38-26)33-8-10-36-11-9-33/h3-7,13-15,19-20H,8-12,16-18H2,1-2H3,(H,31,35)/t19-,20+
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n/an/a 6n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of ATM (unknown origin) by biochemical assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550679
PNG
(CHEMBL4740512)
Show SMILES CCN1CC(C1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1
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n/an/a 7n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550652
PNG
(CHEMBL4792283)
Show SMILES O=C(CN1CCCC1)Nc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1
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n/an/a 10n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50208517
PNG
(2-morpholin-4-yl-6-thianthren-1-yl-pyran-4-one | C...)
Show SMILES O=c1cc(oc(c1)-c1cccc2Sc3ccccc3Sc12)N1CCOCC1
Show InChI InChI=1S/C21H17NO3S2/c23-14-12-16(25-20(13-14)22-8-10-24-11-9-22)15-4-3-7-19-21(15)27-18-6-2-1-5-17(18)26-19/h1-7,12-13H,8-11H2
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TBA

Assay Description
Inhibition of ATM (unknown origin) by biochemical assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM50550673
PNG
(CHEMBL4745255)
Show SMILES C[C@H](CN1CCOCC1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
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n/an/a 14n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human VPS34 incubated for 60 mins by ADP-Glo kinase assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550656
PNG
(CHEMBL4744385)
Show SMILES CN(C(C)=O)c1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1
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n/an/a 16n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM50059640
PNG
(CHEMBL2140173)
Show SMILES C[C@H]1CN(CC(=O)Nc2ccc3Sc4c(Cc3c2)cccc4-c2cc(=O)cc(o2)N2CCOCC2)C[C@@H](C)O1
Show InChI InChI=1S/C30H33N3O5S/c1-19-16-32(17-20(2)37-19)18-28(35)31-23-6-7-27-22(13-23)12-21-4-3-5-25(30(21)39-27)26-14-24(34)15-29(38-26)33-8-10-36-11-9-33/h3-7,13-15,19-20H,8-12,16-18H2,1-2H3,(H,31,35)/t19-,20+
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n/an/a 17n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human VPS34 incubated for 60 mins by ADP-Glo kinase assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM50550686
PNG
(CHEMBL4760480)
Show SMILES O=c1cc(oc(c1)-c1cccc2Cc3cc(OC4COC4)ccc3Sc12)N1CCOCC1
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n/an/a 20n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human VPS34 incubated for 60 mins by ADP-Glo kinase assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550678
PNG
(CHEMBL4783168)
Show SMILES FC(F)CN1CC[C@H](C1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
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n/an/a 20n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50059640
PNG
(CHEMBL2140173)
Show SMILES C[C@H]1CN(CC(=O)Nc2ccc3Sc4c(Cc3c2)cccc4-c2cc(=O)cc(o2)N2CCOCC2)C[C@@H](C)O1
Show InChI InChI=1S/C30H33N3O5S/c1-19-16-32(17-20(2)37-19)18-28(35)31-23-6-7-27-22(13-23)12-21-4-3-5-25(30(21)39-27)26-14-24(34)15-29(38-26)33-8-10-36-11-9-33/h3-7,13-15,19-20H,8-12,16-18H2,1-2H3,(H,31,35)/t19-,20+
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TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM50550669
PNG
(CHEMBL4794132)
Show SMILES C[C@H](CN1C[C@H](C)O[C@H](C)C1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
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n/an/a 24n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human VPS34 incubated for 60 mins by ADP-Glo kinase assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM50550657
PNG
(CHEMBL4792737)
Show SMILES COc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1
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n/an/a 29n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human VPS34 incubated for 60 mins by ADP-Glo kinase assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550672
PNG
(CHEMBL4787824)
Show SMILES C[C@@H](CN1CCCC11COC1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
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n/an/a 30n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM50550684
PNG
(CHEMBL4752634)
Show SMILES COC[C@@H](C)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
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n/an/a 41n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human VPS34 incubated for 60 mins by ADP-Glo kinase assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550689
PNG
(CHEMBL4783459)
Show SMILES COc1ccc2Sc3c(cccc3C3(CCOCC3)c2c1)-c1cc(=O)cc(o1)N1CCOCC1
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n/an/a 50n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human FLAG-tagged ATM assessed as reduction in p53 S15 phosphorylation incubated for 30 mins by ELISA


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Phosphatidylinositol 3-kinase catalytic subunit type 3


(Homo sapiens (Human))
BDBM50550678
PNG
(CHEMBL4783168)
Show SMILES FC(F)CN1CC[C@H](C1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
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n/an/a 67n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of recombinant full-length human VPS34 incubated for 60 mins by ADP-Glo kinase assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550669
PNG
(CHEMBL4794132)
Show SMILES C[C@H](CN1C[C@H](C)O[C@H](C)C1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
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n/an/a 70n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of ATM in human MCF7 cells assessed as reduction in etoposide-stimulated KAP1 phosphorylation incubated for 1 hr by ICW assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
Serine-protein kinase ATM


(Homo sapiens (Human))
BDBM50550673
PNG
(CHEMBL4745255)
Show SMILES C[C@H](CN1CCOCC1)Oc1ccc2Sc3c(Cc2c1)cccc3-c1cc(=O)cc(o1)N1CCOCC1 |r|
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n/an/a 70n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of ATM in human MCF7 cells assessed as reduction in etoposide-stimulated KAP1 phosphorylation incubated for 1 hr by ICW assay


Citation and Details

Article DOI: 10.1021/acs.jmedchem.8b01819
BindingDB Entry DOI: 10.7270/Q29G5RF2
More data for this
Ligand-Target Pair
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