BDBM50448091 CHEMBL3121317

SMILES: COc1ncc(cc1NS(=O)(=O)C(C)C)-c1ccc2nc(N)n(-c3ccccc3)c(=O)c2c1

InChI Key: InChIKey=XMKQZYFAHHTULJ-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 = 50448091   

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 (Homo sapiens (Human))	BDBM50448091 (CHEMBL3121317) Show SMILES COc1ncc(cc1NS(=O)(=O)C(C)C)-c1ccc2nc(N)n(-c3ccccc3)c(=O)c2c1 Show InChI InChI=1S/C23H23N5O4S/c1-14(2)33(30,31)27-20-12-16(13-25-21(20)32-3)15-9-10-19-18(11-15)22(29)28(23(24)26-19)17-7-5-4-6-8-17/h4-14,27H,1-3H3,(H2,24,26)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	501	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of PI3Kgamma (2 to 1102) (unknown origin) using diC8-PIP2 as substrate preincubated for 30 mins followed by substrate addition measured af...				J Med Chem 57: 2091-106 (2014) Article DOI: 10.1021/jm400781h BindingDB Entry DOI: 10.7270/Q2WH2RG0
					More data for this Ligand-Target Pair
Phosphatidylinositol 4-kinase alpha (PI4KA) (Homo sapiens (Human))	BDBM50448091 (CHEMBL3121317) Show SMILES COc1ncc(cc1NS(=O)(=O)C(C)C)-c1ccc2nc(N)n(-c3ccccc3)c(=O)c2c1 Show InChI InChI=1S/C23H23N5O4S/c1-14(2)33(30,31)27-20-12-16(13-25-21(20)32-3)15-9-10-19-18(11-15)22(29)28(23(24)26-19)17-7-5-4-6-8-17/h4-14,27H,1-3H3,(H2,24,26)	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	126	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of GST-tagged PI4K-alpha (1 to 2044) (unknown origin) using D-myo-phosphatidylinositol as substrate preincubated for 30 mins followed by s...				J Med Chem 57: 2091-106 (2014) Article DOI: 10.1021/jm400781h BindingDB Entry DOI: 10.7270/Q2WH2RG0
					More data for this Ligand-Target Pair