BDBM182305 US9145392, 6

SMILES: Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C=O)-c1ccc(F)c(c1)C(F)(F)F

InChI Key: InChIKey=OHPGVBAFZWTDHG-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 = 182305   

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
Ribosomal protein S6 kinase (P70S6K) (Homo sapiens (Human))	BDBM182305 (US9145392, 6) Show SMILES Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C=O)-c1ccc(F)c(c1)C(F)(F)F Show InChI InChI=1S/C21H20F4N6O/c1-30-9-17(13-2-3-16(22)15(8-13)21(23,24)25)29-19(30)12-4-6-31(7-5-12)20-14(10-32)18(26)27-11-28-20/h2-3,8-12H,4-7H2,1H3,(H2,26,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	0.600	n/a	n/a	n/a	n/a	7.5	25
Merck Patent GmbH US Patent					Assay Description P70S6K inhibitor compounds are diluted and plated in 96 well plates. A reaction mixture including the following components is then added to the compo...				US Patent US9145392 (2015) BindingDB Entry DOI: 10.7270/Q2NZ86D2
					More data for this Ligand-Target Pair
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM182305 (US9145392, 6) Show SMILES Cn1cc(nc1C1CCN(CC1)c1ncnc(N)c1C=O)-c1ccc(F)c(c1)C(F)(F)F Show InChI InChI=1S/C21H20F4N6O/c1-30-9-17(13-2-3-16(22)15(8-13)21(23,24)25)29-19(30)12-4-6-31(7-5-12)20-14(10-32)18(26)27-11-28-20/h2-3,8-12H,4-7H2,1H3,(H2,26,27,28)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	160	n/a	n/a	n/a	n/a	7.5	n/a
Merck Patent GmbH US Patent					Assay Description A TTP Mosquito liquid handling instrument is used to place 125n1 of the appropriate concentration of inhibitor in 100% DMSO (for a dose response curv...				US Patent US9145392 (2015) BindingDB Entry DOI: 10.7270/Q2NZ86D2
					More data for this Ligand-Target Pair