null

SMILES: CNc1nc2ccccc2n1-c1nc2N3CCOC[C@H]3COc2c(n1)C1(CCC1)S(C)(=O)=O

InChI Key: InChIKey=CRMSNASRCGABPC-AWEZNQCLSA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 251646   

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 3-kinase regulatory subunit alpha/4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM251646 (US9453031, 92) Show SMILES CNc1nc2ccccc2n1-c1nc2N3CCOC[C@H]3COc2c(n1)C1(CCC1)S(C)(=O)=O |r| Show InChI InChI=1S/C22H26N6O4S/c1-23-20-24-15-6-3-4-7-16(15)28(20)21-25-18(22(8-5-9-22)33(2,29)30)17-19(26-21)27-10-11-31-12-14(27)13-32-17/h3-4,6-7,14H,5,8-13H2,1-2H3,(H,23,24)/t14-/m0/s1	PDB UniProtKB/SwissProt antibodypedia antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	2.75E+3	n/a	n/a	n/a	n/a	7.5	25
Fundación Centro Nacional de Investigaciones Oncológicas Carlos III US Patent					Assay Description The kinase activity was measured by using the commercial ADP Hunter Plus assay available from DiscoveRx (#33-016), which is a homogeneous assay to me...				US Patent US9453031 (2016) BindingDB Entry DOI: 10.7270/Q27H1HH8
					More data for this Ligand-Target Pair
DNA-dependent protein kinase catalytic subunit (Homo sapiens (Human))	BDBM251646 (US9453031, 92) Show SMILES CNc1nc2ccccc2n1-c1nc2N3CCOC[C@H]3COc2c(n1)C1(CCC1)S(C)(=O)=O |r| Show InChI InChI=1S/C22H26N6O4S/c1-23-20-24-15-6-3-4-7-16(15)28(20)21-25-18(22(8-5-9-22)33(2,29)30)17-19(26-21)27-10-11-31-12-14(27)13-32-17/h3-4,6-7,14H,5,8-13H2,1-2H3,(H,23,24)/t14-/m0/s1	PDB KEGG UniProtKB/SwissProt DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	6.15E+3	n/a	n/a	n/a	n/a	7.5	37
Fundación Centro Nacional de Investigaciones Oncológicas Carlos III US Patent					Assay Description The kinase activity was measured by using the commercial ADP Hunter Plus assay available from DiscoveRx (#90-0083), which is a homogeneous assay to m...				US Patent US9453031 (2016) BindingDB Entry DOI: 10.7270/Q27H1HH8
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR [1360-2549] (Homo sapiens (Human))	BDBM251646 (US9453031, 92) Show SMILES CNc1nc2ccccc2n1-c1nc2N3CCOC[C@H]3COc2c(n1)C1(CCC1)S(C)(=O)=O |r| Show InChI InChI=1S/C22H26N6O4S/c1-23-20-24-15-6-3-4-7-16(15)28(20)21-25-18(22(8-5-9-22)33(2,29)30)17-19(26-21)27-10-11-31-12-14(27)13-32-17/h3-4,6-7,14H,5,8-13H2,1-2H3,(H,23,24)/t14-/m0/s1	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	US Patent	n/a	n/a	1.24E+3	n/a	n/a	n/a	n/a	7.5	25
Fundación Centro Nacional de Investigaciones Oncológicas Carlos III US Patent					Assay Description The enzymatic mTOR activity was measured using a LanthaScreen kinase activity assay (Invitrogen). The enzyme was purchased from Invitrogen (PV4754), ...				US Patent US9453031 (2016) BindingDB Entry DOI: 10.7270/Q27H1HH8
					More data for this Ligand-Target Pair