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 = 'BDBM50091690'   

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 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50091690 (CHEMBL3582355) Show SMILES COc1ccc(cn1)-c1cccc(CNc2ccc(cc2)S(=O)(=O)Nc2nnc(C)s2)c1 Show InChI InChI=1S/C22H21N5O3S2/c1-15-25-26-22(31-15)27-32(28,29)20-9-7-19(8-10-20)23-13-16-4-3-5-17(12-16)18-6-11-21(30-2)24-14-18/h3-12,14,23H,13H2,1-2H3,(H,26,27)	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/a	n/a	102	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of wild type his-tagged PI3Kalpha (unknown origin)				ACS Med Chem Lett 6: 531-6 (2015) Article DOI: 10.1021/acsmedchemlett.5b00025 BindingDB Entry DOI: 10.7270/Q2BP04JF
					More data for this Ligand-Target Pair