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Compile Data Set for Download or QSAR

Found 1 hit from Biomedical Research Foundation Academy of Athens (BRFAA)   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM50234112
PNG
(CHEMBL4083528)
Show SMILES Cc1nc2nc(Sc3ccccc3)cnc2cc1NC(=O)Nc1ccccc1
Show InChI InChI=1S/C21H17N5OS/c1-14-17(25-21(27)24-15-8-4-2-5-9-15)12-18-20(23-14)26-19(13-22-18)28-16-10-6-3-7-11-16/h2-13H,1H3,(H2,24,25,27)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
GoogleScholar
PC cid
PC sid
UniChem

Patents

Article
PubMed
n/an/a 2.60E+4n/an/an/an/an/an/a



Biomedical Research Foundation Academy of Athens (BRFAA)

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha catalytic domain (unknown origin) using PIP2 liposomes as substrate in presence of biotin-labeled PIP3 and GST-GRP1-PH by str...


Eur J Med Chem 126: 954-968 (2017)


Article DOI: 10.1016/j.ejmech.2016.12.025
More data for this
Ligand-Target Pair