BDBM50426796 CHEMBL2322765

SMILES: CC(C)Cn1ncnc1-c1cc2CCOc3cc(ccc3-c2s1)C(N)=O

InChI Key: InChIKey=VUWJKFVIFGXVMU-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50426796   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50426796 (CHEMBL2322765) Show SMILES CC(C)Cn1ncnc1-c1cc2CCOc3cc(ccc3-c2s1)C(N)=O Show InChI InChI=1S/C19H20N4O2S/c1-11(2)9-23-19(21-10-22-23)16-8-12-5-6-25-15-7-13(18(20)24)3-4-14(15)17(12)26-16/h3-4,7-8,10-11H,5-6,9H2,1-2H3,(H2,20,24)	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	4	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc. Curated by ChEMBL					Assay Description Inhibition of recombinant PI3Kalpha (unknown origin)-mediated 3,4,5-inositoltriphosphate formation after 30 mins by TAMRA-PIP3-based competitive fluo...				Bioorg Med Chem Lett 23: 897-901 (2013) Article DOI: 10.1016/j.bmcl.2012.10.121 BindingDB Entry DOI: 10.7270/Q21C1Z5X
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50426796 (CHEMBL2322765) Show SMILES CC(C)Cn1ncnc1-c1cc2CCOc3cc(ccc3-c2s1)C(N)=O Show InChI InChI=1S/C19H20N4O2S/c1-11(2)9-23-19(21-10-22-23)16-8-12-5-6-25-15-7-13(18(20)24)3-4-14(15)17(12)26-16/h3-4,7-8,10-11H,5-6,9H2,1-2H3,(H2,20,24)	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	279	n/a	n/a	n/a	n/a	n/a	n/a
Genentech, Inc. Curated by ChEMBL					Assay Description Inhibition of PI3Kalpha-mediated AKT Ser 473 phosphorylation in human PC3 cells				Bioorg Med Chem Lett 23: 897-901 (2013) Article DOI: 10.1016/j.bmcl.2012.10.121 BindingDB Entry DOI: 10.7270/Q21C1Z5X
					More data for this Ligand-Target Pair