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PubMed code 27774129

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))
BDBM50193033
PNG
(CHEMBL3902260)
Show SMILES COCCn1cnc2ccc(cc2c1=O)-c1cnc(COC2CC2)c(NS(=O)(=O)c2ccc(F)cc2F)c1
Show InChI InChI=1S/C26H24F2N4O5S/c1-36-9-8-32-15-30-22-6-2-16(10-20(22)26(32)33)17-11-23(24(29-13-17)14-37-19-4-5-19)31-38(34,35)25-7-3-18(27)12-21(25)28/h2-3,6-7,10-13,15,19,31H,4-5,8-9,14H2,1H3
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MMDB

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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 240n/an/an/an/an/an/a



Japan Tobacco Inc.

Curated by ChEMBL


Assay Description
Inhibition of PI3Kalpha (unknown origin) preincubated prior addition of PIP2 as substrate and ATP measured after 30 mins by HTRF assay


ACS Med Chem Lett 7: 919-923 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00232
BindingDB Entry DOI: 10.7270/Q23X88M8
More data for this
Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit beta isoform


(Homo sapiens (Human))
BDBM50193033
PNG
(CHEMBL3902260)
Show SMILES COCCn1cnc2ccc(cc2c1=O)-c1cnc(COC2CC2)c(NS(=O)(=O)c2ccc(F)cc2F)c1
Show InChI InChI=1S/C26H24F2N4O5S/c1-36-9-8-32-15-30-22-6-2-16(10-20(22)26(32)33)17-11-23(24(29-13-17)14-37-19-4-5-19)31-38(34,35)25-7-3-18(27)12-21(25)28/h2-3,6-7,10-13,15,19,31H,4-5,8-9,14H2,1H3
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.40E+3n/an/an/an/an/an/a



Japan Tobacco Inc.

Curated by ChEMBL


Assay Description
Inhibition of PI3Kbeta (unknown origin) preincubated prior addition of PIP2 as substrate and ATP measured after 30 mins by HTRF assay


ACS Med Chem Lett 7: 919-923 (2016)


Article DOI: 10.1021/acsmedchemlett.6b00232
BindingDB Entry DOI: 10.7270/Q23X88M8
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%