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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform' and Ligand = 'BDBM50207172'   
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))
BDBM50207172
PNG
(CHEMBL534951 | [3-(4-morpholin-4-yl-pyrido[3',2':4...)
Show SMILES OC(=O)COc1cccc(c1)-c1nc(N2CCOCC2)c2oc3ncccc3c2n1
Show InChI InChI=1S/C21H18N4O5/c26-16(27)12-29-14-4-1-3-13(11-14)19-23-17-15-5-2-6-22-21(15)30-18(17)20(24-19)25-7-9-28-10-8-25/h1-6,11H,7-10,12H2,(H,26,27)
PDB
MMDB

NCI pathway
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Similars

Article
PubMed
n/an/a 24n/an/an/an/an/an/a



Astellas Pharma Inc.

Curated by ChEMBL


Assay Description
Inhibition of p110alpha by SPA assay


Bioorg Med Chem Lett 17: 2438-42 (2007)


Article DOI: 10.1016/j.bmcl.2007.02.032
BindingDB Entry DOI: 10.7270/Q28053F2
More data for this
Ligand-Target Pair