BDBM50429886 CHEMBL2332920

SMILES: NS(=O)(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1

InChI Key: InChIKey=RUCDUJBXFVQAEL-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50429886   

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))	BDBM50429886 (CHEMBL2332920) Show SMILES NS(=O)(=O)c1ccc(cc1)C(=O)N1CCOc2ccc(cc2C1)-c1ccc2nc[nH]c2c1 Show InChI InChI=1S/C23H20N4O4S/c24-32(29,30)19-5-1-15(2-6-19)23(28)27-9-10-31-22-8-4-16(11-18(22)13-27)17-3-7-20-21(12-17)26-14-25-20/h1-8,11-12,14H,9-10,13H2,(H,25,26)(H2,24,29,30)	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	763	n/a	n/a	n/a	n/a	n/a	n/a
Exelixis Curated by ChEMBL					Assay Description Inhibition of PI3Kalpha (unknown origin) using PIP2 as substrate after 2 hrs by luminescence assay				J Med Chem 56: 2218-34 (2013) Article DOI: 10.1021/jm3007933 BindingDB Entry DOI: 10.7270/Q2ZC847X
					More data for this Ligand-Target Pair