BDBM50365521 CHEMBL1957487

SMILES: Oc1cccc(c1)-c1cn2cc(nc2c(n1)N1CCOCC1)C(F)(F)F

InChI Key: InChIKey=CYHPIECDPXPPLI-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 = 50365521   

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 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50365521 (CHEMBL1957487) Show SMILES Oc1cccc(c1)-c1cn2cc(nc2c(n1)N1CCOCC1)C(F)(F)F Show InChI InChI=1S/C17H15F3N4O2/c18-17(19,20)14-10-24-9-13(11-2-1-3-12(25)8-11)21-15(16(24)22-14)23-4-6-26-7-5-23/h1-3,8-10,25H,4-7H2	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	108	n/a	n/a	n/a	n/a	n/a	n/a
Spanish National Cancer Research Centre (CNIO). C/Melchor Fern£ndez Almagro 3 Curated by ChEMBL					Assay Description Inhibition of PI3K p110alpha/p85alpha				Bioorg Med Chem Lett 22: 1874-8 (2012) Article DOI: 10.1016/j.bmcl.2012.01.074 BindingDB Entry DOI: 10.7270/Q29Z95DX
					More data for this Ligand-Target Pair