BDBM50387585 CHEMBL2057732

SMILES: CCN(CC)n1c2nc(N)nc(C)c2cc(-c2cn[nH]c2)c1=O

InChI Key: InChIKey=XSTNXAHHGBGWCQ-UHFFFAOYSA-N

Data: 2 KI

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 = 50387585   

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 (PI3K alpha) (Mus musculus (Mouse))	BDBM50387585 (CHEMBL2057732) Show SMILES CCN(CC)n1c2nc(N)nc(C)c2cc(-c2cn[nH]c2)c1=O Show InChI InChI=1S/C15H19N7O/c1-4-21(5-2)22-13-11(9(3)19-15(16)20-13)6-12(14(22)23)10-7-17-18-8-10/h6-8H,4-5H2,1-3H3,(H,17,18)(H2,16,19,20)	PDB UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	138	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of mouse PI3Kalpha				Bioorg Med Chem Lett 22: 5098-103 (2012) Article DOI: 10.1016/j.bmcl.2012.05.100 BindingDB Entry DOI: 10.7270/Q2CF9R58
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50387585 (CHEMBL2057732) Show SMILES CCN(CC)n1c2nc(N)nc(C)c2cc(-c2cn[nH]c2)c1=O Show InChI InChI=1S/C15H19N7O/c1-4-21(5-2)22-13-11(9(3)19-15(16)20-13)6-12(14(22)23)10-7-17-18-8-10/h6-8H,4-5H2,1-3H3,(H,17,18)(H2,16,19,20)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	663	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Pfizer Inc. Curated by ChEMBL					Assay Description Inhibition of human mTOR				Bioorg Med Chem Lett 22: 5098-103 (2012) Article DOI: 10.1016/j.bmcl.2012.05.100 BindingDB Entry DOI: 10.7270/Q2CF9R58
					More data for this Ligand-Target Pair