Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform' and Ligand = 'BDBM50174999'   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Phosphatidylinositol 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50174999 (CHEMBL3808833) Show SMILES CN(C(=O)N1CCc2c1nc(nc2-c1cnc(N)nc1)N1CCOCC1)c1ccccc1 Show InChI InChI=1S/C22H24N8O2/c1-28(16-5-3-2-4-6-16)22(31)30-8-7-17-18(15-13-24-20(23)25-14-15)26-21(27-19(17)30)29-9-11-32-12-10-29/h2-6,13-14H,7-12H2,1H3,(H2,23,24,25)	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	130	n/a	n/a	n/a	n/a	n/a	n/a
Chugai Pharmaceutical Co., Ltd Curated by ChEMBL					Assay Description Inhibition of human PI3K p110alpha/p85alpha expressed in baculovirus preincubated for 20 mins followed by addition of phosphorylate phosphatidylinosi...				Bioorg Med Chem 24: 2897-2906 (2016) Article DOI: 10.1016/j.bmc.2016.04.060 BindingDB Entry DOI: 10.7270/Q21J9CQT
					More data for this Ligand-Target Pair