BDBM50365875 CHEMBL1957864

SMILES: Fc1c(nc2n(Cc3cccc(Cl)c3Cl)ccn2c1=O)N1CCOCC1

InChI Key: InChIKey=UMOMABKQZQXMHW-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 50365875   

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 beta isoform (Homo sapiens (Human))	BDBM50365875 (CHEMBL1957864) Show SMILES Fc1c(nc2n(Cc3cccc(Cl)c3Cl)ccn2c1=O)N1CCOCC1 Show InChI InChI=1S/C17H15Cl2FN4O2/c18-12-3-1-2-11(13(12)19)10-23-4-5-24-16(25)14(20)15(21-17(23)24)22-6-8-26-9-7-22/h1-5H,6-10H2	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	25	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of PI3Kbeta by time-resolved FRET displacement assay				Bioorg Med Chem Lett 22: 2230-4 (2012) Article DOI: 10.1016/j.bmcl.2012.01.092 BindingDB Entry DOI: 10.7270/Q2GH9JF0
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50365875 (CHEMBL1957864) Show SMILES Fc1c(nc2n(Cc3cccc(Cl)c3Cl)ccn2c1=O)N1CCOCC1 Show InChI InChI=1S/C17H15Cl2FN4O2/c18-12-3-1-2-11(13(12)19)10-23-4-5-24-16(25)14(20)15(21-17(23)24)22-6-8-26-9-7-22/h1-5H,6-10H2	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	790	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of PI3Kalpha by time-resolved FRET displacement assay				Bioorg Med Chem Lett 22: 2230-4 (2012) Article DOI: 10.1016/j.bmcl.2012.01.092 BindingDB Entry DOI: 10.7270/Q2GH9JF0
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform (Homo sapiens (Human))	BDBM50365875 (CHEMBL1957864) Show SMILES Fc1c(nc2n(Cc3cccc(Cl)c3Cl)ccn2c1=O)N1CCOCC1 Show InChI InChI=1S/C17H15Cl2FN4O2/c18-12-3-1-2-11(13(12)19)10-23-4-5-24-16(25)14(20)15(21-17(23)24)22-6-8-26-9-7-22/h1-5H,6-10H2	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	1.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of PI3Kgamma by time-resolved FRET displacement assay				Bioorg Med Chem Lett 22: 2230-4 (2012) Article DOI: 10.1016/j.bmcl.2012.01.092 BindingDB Entry DOI: 10.7270/Q2GH9JF0
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit delta isoform (Homo sapiens (Human))	BDBM50365875 (CHEMBL1957864) Show SMILES Fc1c(nc2n(Cc3cccc(Cl)c3Cl)ccn2c1=O)N1CCOCC1 Show InChI InChI=1S/C17H15Cl2FN4O2/c18-12-3-1-2-11(13(12)19)10-23-4-5-24-16(25)14(20)15(21-17(23)24)22-6-8-26-9-7-22/h1-5H,6-10H2	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	31	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Inhibition of PI3Kdelta by time-resolved FRET displacement assay				Bioorg Med Chem Lett 22: 2230-4 (2012) Article DOI: 10.1016/j.bmcl.2012.01.092 BindingDB Entry DOI: 10.7270/Q2GH9JF0
					More data for this Ligand-Target Pair