BDBM182504 US9145392, 205

SMILES: Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2cnc(F)c(Cl)c2)c1C#N

InChI Key: InChIKey=DLFSJMCJAANTKH-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 = 182504   

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
RAC-alpha serine/threonine-protein kinase (Homo sapiens (Human))	BDBM182504 (US9145392, 205) Show SMILES Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2cnc(F)c(Cl)c2)c1C#N Show InChI InChI=1S/C23H25ClFN9/c24-18-10-16(12-28-20(18)25)19-13-34(9-8-32-4-1-5-32)22(31-19)15-2-6-33(7-3-15)23-17(11-26)21(27)29-14-30-23/h10,12-15H,1-9H2,(H2,27,29,30)	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	US Patent	n/a	n/a	1.30	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
Ribosomal protein S6 kinase (P70S6K) (Homo sapiens (Human))	BDBM182504 (US9145392, 205) Show SMILES Nc1ncnc(N2CCC(CC2)c2nc(cn2CCN2CCC2)-c2cnc(F)c(Cl)c2)c1C#N Show InChI InChI=1S/C23H25ClFN9/c24-18-10-16(12-28-20(18)25)19-13-34(9-8-32-4-1-5-32)22(31-19)15-2-6-33(7-3-15)23-17(11-26)21(27)29-14-30-23/h10,12-15H,1-9H2,(H2,27,29,30)	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	0.800	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