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PubMed code 28129991

Compile data set for download or QSAR
Found 2 hits of Enzyme Inhibition Constant Data   
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
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM74255
PNG
((3-amino-2-methyl-phenyl)amine | 1,3-Benzenediamin...)
Show SMILES Cc1c(N)cccc1N
Show InChI InChI=1S/C7H10N2/c1-5-6(8)3-2-4-7(5)9/h2-4H,8-9H2,1H3
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MMDB

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PC cid
PC sid
PDB
UniChem
PDB
Article
PubMed
n/an/a 2.00E+4n/an/an/an/an/an/a



Johns Hopkins University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of full length PI3Kalpha (unknown origin) assessed as reduction in PIP3 formation using PIP2 as substrate after 45 mins by fluorescence po...


Bioorg Med Chem 25: 1481-1486 (2017)


Article DOI: 10.1016/j.bmc.2017.01.012
BindingDB Entry DOI: 10.7270/Q2028TQP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform


(Homo sapiens (Human))
BDBM26188
PNG
(α-CA inhibitor, 12 | 1,2-Dihydroxybenzene, XI...)
Show SMILES Oc1ccccc1O
Show InChI InChI=1S/C6H6O2/c7-5-3-1-2-4-6(5)8/h1-4,7-8H
PDB
MMDB

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KEGG

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CHEMBL
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PC cid
PC sid
PDB
UniChem

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Similars

PDB
Article
PubMed
n/an/a 3.30E+4n/an/an/an/an/an/a



Johns Hopkins University School of Medicine

Curated by ChEMBL


Assay Description
Inhibition of full length PI3Kalpha (unknown origin) assessed as reduction in PIP3 formation using PIP2 as substrate after 45 mins by fluorescence po...


Bioorg Med Chem 25: 1481-1486 (2017)


Article DOI: 10.1016/j.bmc.2017.01.012
BindingDB Entry DOI: 10.7270/Q2028TQP
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
* indicates data uncertainty>20%