BDBM50533532 CHEMBL4446205

SMILES: [H][C@]12CN(C[C@]1([H])OCCO2)c1nc(cc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1

InChI Key: InChIKey=YBSONZDEWIPQTP-HOTGVXAUSA-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 = 50533532   

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 gamma isoform/Phosphoinositide 3-kinase regulatory subunit 5 (Homo sapiens (Human))	BDBM50533532 (CHEMBL4446205) Show SMILES [H][C@]12CN(C[C@]1([H])OCCO2)c1nc(cc(n1)-c1cnc(N)cc1C(F)(F)F)N1CCOCC1 |r| Show InChI InChI=1S/C20H23F3N6O3/c21-20(22,23)13-7-17(24)25-9-12(13)14-8-18(28-1-3-30-4-2-28)27-19(26-14)29-10-15-16(11-29)32-6-5-31-15/h7-9,15-16H,1-6,10-11H2,(H2,24,25)/t15-,16-/m0/s1	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	158	n/a	n/a	n/a	n/a	n/a	n/a
Sun Yat-sen University Curated by ChEMBL					Assay Description Inhibition of PI3K p110gamma/p101 (unknown origin) using PIP2/ATP as substrate after 1 hr by kinase glo luminescent assay				J Med Chem 59: 7268-74 (2016) Article DOI: 10.1021/acs.jmedchem.6b00235
					More data for this Ligand-Target Pair