BDBM178338 US9120812, 123

SMILES: CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCCF)cc3)c2C1=O)N1CC2CCC(C1)O2

InChI Key: InChIKey=FTFOMERAQYZMLK-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 = 178338   

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
PI3-kinase class I (Homo sapiens (Human))	BDBM178338 (US9120812, 123) Show SMILES CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCCF)cc3)c2C1=O)N1CC2CCC(C1)O2 Show InChI InChI=1S/C26H33FN6O4/c1-4-32-15-26(2,3)37-22-20(23(32)34)21(16-5-7-17(8-6-16)29-25(35)28-12-11-27)30-24(31-22)33-13-18-9-10-19(14-33)36-18/h5-8,18-19H,4,9-15H2,1-3H3,(H2,28,29,35)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	3.63E+3	n/a	n/a	n/a	n/a	7.5	n/a
Sanofi US Patent					Assay Description The test uses a lucifeurerin/luciferase system to measure the concentration of ATP and its consumption during the enzymatic reaction. The test is per...				US Patent US9120812 (2015) BindingDB Entry DOI: 10.7270/Q2KH0M2D
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM178338 (US9120812, 123) Show SMILES CCN1CC(C)(C)Oc2nc(nc(-c3ccc(NC(=O)NCCF)cc3)c2C1=O)N1CC2CCC(C1)O2 Show InChI InChI=1S/C26H33FN6O4/c1-4-32-15-26(2,3)37-22-20(23(32)34)21(16-5-7-17(8-6-16)29-25(35)28-12-11-27)30-24(31-22)33-13-18-9-10-19(14-33)36-18/h5-8,18-19H,4,9-15H2,1-3H3,(H2,28,29,35)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	22	n/a	n/a	n/a	n/a	7.5	25
Sanofi US Patent					Assay Description The test detects the phosphorylation of the substrate GFP-4EBP1 using a terbium-labelled antibody that is specific for the phospho-Thr46 epitope. Bin...				US Patent US9120812 (2015) BindingDB Entry DOI: 10.7270/Q2KH0M2D
					More data for this Ligand-Target Pair