BDBM50305292 (3-(9-(1-(2,4-difluorophenyl)piperidin-4-yl)-6-morpholino-9H-purin-2-yl)phenyl)methanol::CHEMBL591576

SMILES: OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(CC3)c3ccc(F)cc3F)c2n1

InChI Key: InChIKey=UXNMHXVQYCSDTB-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 50305292   

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))	BDBM50305292 ((3-(9-(1-(2,4-difluorophenyl)piperidin-4-yl)-6-mor...) Show SMILES OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(CC3)c3ccc(F)cc3F)c2n1 Show InChI InChI=1S/C27H28F2N6O2/c28-20-4-5-23(22(29)15-20)33-8-6-21(7-9-33)35-17-30-24-26(34-10-12-37-13-11-34)31-25(32-27(24)35)19-3-1-2-18(14-19)16-36/h1-5,14-15,17,21,36H,6-13,16H2	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	44	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of PI3Kalpha				Bioorg Med Chem Lett 20: 653-6 (2010) Article DOI: 10.1016/j.bmcl.2009.11.057 BindingDB Entry DOI: 10.7270/Q2X63N1H
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50305292 ((3-(9-(1-(2,4-difluorophenyl)piperidin-4-yl)-6-mor...) Show SMILES OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(CC3)c3ccc(F)cc3F)c2n1 Show InChI InChI=1S/C27H28F2N6O2/c28-20-4-5-23(22(29)15-20)33-8-6-21(7-9-33)35-17-30-24-26(34-10-12-37-13-11-34)31-25(32-27(24)35)19-3-1-2-18(14-19)16-36/h1-5,14-15,17,21,36H,6-13,16H2	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	2.05E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of mTOR				Bioorg Med Chem Lett 20: 653-6 (2010) Article DOI: 10.1016/j.bmcl.2009.11.057 BindingDB Entry DOI: 10.7270/Q2X63N1H
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit gamma isoform (Homo sapiens (Human))	BDBM50305292 ((3-(9-(1-(2,4-difluorophenyl)piperidin-4-yl)-6-mor...) Show SMILES OCc1cccc(c1)-c1nc(N2CCOCC2)c2ncn(C3CCN(CC3)c3ccc(F)cc3F)c2n1 Show InChI InChI=1S/C27H28F2N6O2/c28-20-4-5-23(22(29)15-20)33-8-6-21(7-9-33)35-17-30-24-26(34-10-12-37-13-11-34)31-25(32-27(24)35)19-3-1-2-18(14-19)16-36/h1-5,14-15,17,21,36H,6-13,16H2	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	640	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of PI3Kgamma				Bioorg Med Chem Lett 20: 653-6 (2010) Article DOI: 10.1016/j.bmcl.2009.11.057 BindingDB Entry DOI: 10.7270/Q2X63N1H
					More data for this Ligand-Target Pair