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Compile Data Set for Download or QSAR
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
14
hits in this display
Target
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50343200
(CHEMBL1615189 | N-(6-(6-Chloro-5-(4-fluorophenylsu...)
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Affinity Data
Ki: 1.20nM
Assay Description:
Inhibition of human PI3Kalpha using PI(4,5)P2 as substrate after 20 mins by alphascreen assay in presence of 20 uM ATP
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
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KEGG
UniProtKB/SwissProt
B.MOAD
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antibodypedia
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Article
PubMed
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Target
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50343200
(CHEMBL1615189 | N-(6-(6-Chloro-5-(4-fluorophenylsu...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 1.20nM
Assay Description:
Inhibition of human PI3Kalpha expressed in Sf9 cells
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MMDB
PC cid
PC sid
PDB
Patents
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In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50343200
(CHEMBL1615189 | N-(6-(6-Chloro-5-(4-fluorophenylsu...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 1.20nM
Assay Description:
Inhibition of PI3Kalpha-mediated Akt phosphorylation at Ser 473 in human U87MG cells
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MMDB
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PC sid
PDB
Patents
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In Depth
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Article
PubMed
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Target
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50343200
(CHEMBL1615189 | N-(6-(6-Chloro-5-(4-fluorophenylsu...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 1.20nM
Assay Description:
Inhibition of human PI3Kdelta expressed in Sf9 cells
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MMDB
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PC sid
PDB
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In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50343200
(CHEMBL1615189 | N-(6-(6-Chloro-5-(4-fluorophenylsu...)
Copy SMILES
Copy InChI
Affinity Data
Ki: 2nM
Assay Description:
Inhibition of human PI3Kbeta expressed in Sf9 cells
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MMDB
PC cid
PC sid
PDB
Patents
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In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50343200
(CHEMBL1615189 | N-(6-(6-Chloro-5-(4-fluorophenylsu...)
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Affinity Data
Ki: 4.70nM
Assay Description:
Inhibition of human PI3Kgamma expressed in Sf9 cells
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
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CHEMBL
MMDB
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PDB
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In Depth
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Article
PubMed
MMDB
PDB
3D Structure (crystal)
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Target
Phosphatidylinositol 3-kinase catalytic subunit type 3
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50343200
(CHEMBL1615189 | N-(6-(6-Chloro-5-(4-fluorophenylsu...)
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Affinity Data
Ki: 31nM
Assay Description:
Inhibition of human VPS34 after 30 mins by fluorescence-based immunoassay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
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Ligand Info
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CHEMBL
MMDB
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In Depth
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Article
PubMed
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Target
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50343200
(CHEMBL1615189 | N-(6-(6-Chloro-5-(4-fluorophenylsu...)
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Affinity Data
IC50: 2nM
Assay Description:
Inhibition of mTOR assessed as inhibition of 4EBP1 phosphorylation by TR-FRET assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
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CHEMBL
MMDB
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PC sid
PDB
Patents
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In Depth
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Article
PubMed
Copy BDB DOI
Target
Serine/threonine-protein kinase mTOR
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50343200
(CHEMBL1615189 | N-(6-(6-Chloro-5-(4-fluorophenylsu...)
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Affinity Data
IC50: 2nM
Assay Description:
Inhibition of recombinant N-terminal GST-tagged mTOR-mediated 4E-BP1 phosphorylation after 60 mins by TR-FRET assay
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
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CHEMBL
MMDB
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PC sid
PDB
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In Depth
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Article
PubMed
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Target
DNA-dependent protein kinase catalytic subunit
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50343200
(CHEMBL1615189 | N-(6-(6-Chloro-5-(4-fluorophenylsu...)
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Affinity Data
IC50: 3nM
Assay Description:
Inhibition of DNA-PK after 30 mins by TR-FRET assay
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MMDB
PC cid
PC sid
PDB
Patents
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In Depth
Details
Article
PubMed
Copy BDB DOI
Target
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50343200
(CHEMBL1615189 | N-(6-(6-Chloro-5-(4-fluorophenylsu...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 6.30nM
Assay Description:
Inhibition of AKT phosphorylation at S473 in human U-87MG cells at 5 mM after 2 hrs
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
UniProtKB/SwissProt
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MMDB
PC cid
PC sid
PDB
Patents
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50343200
(CHEMBL1615189 | N-(6-(6-Chloro-5-(4-fluorophenylsu...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 6.30nM
Assay Description:
Inhibition of PI3Kalpha-mediated Akt phosphorylation at Ser 473 in human U87MG cells
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MMDB
PC cid
PC sid
PDB
Patents
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
RAC-alpha serine/threonine-protein kinase
(Homo sapiens (Human))
Amgen
Curated by
ChEMBL
Ligand
BDBM50343200
(CHEMBL1615189 | N-(6-(6-Chloro-5-(4-fluorophenylsu...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 6.30nM
Assay Description:
Inhibition of PI3K-mediated Akt phosphorylation at Ser 473 in human U87MG cells after 2 hrs by alphascreen assay
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
UniProtKB/SwissProt
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
MMDB
PC cid
PC sid
PDB
Patents
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI
Target
Smoothened homolog
(Mus musculus)
Soochow University
Curated by
ChEMBL
Ligand
BDBM50343200
(CHEMBL1615189 | N-(6-(6-Chloro-5-(4-fluorophenylsu...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 120nM
Assay Description:
Inhibition of SMO in mouse NIH/3T3 cells assessed as inhibition of SAG-induced hedgehog-mediated luminescence signaling by GRE-luciferase reporter ge...
More data for this Ligand-Target Pair
Target Info
PDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
Ligand Info
Purchase
CHEMBL
MMDB
PC cid
PC sid
PDB
Patents
Similars
In Depth
Details
Article
PubMed
Copy BDB DOI