Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase mTOR' and Ligand = 'BDBM50362928'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50362928 (CHEMBL1945955) Show SMILES O=c1[nH]c2ncc(nc2n1CC1CCOCC1)-c1ccc(cc1)-c1ncc[nH]1 Show InChI InChI=1S/C20H20N6O2/c27-20-25-18-19(26(20)12-13-5-9-28-10-6-13)24-16(11-23-18)14-1-3-15(4-2-14)17-21-7-8-22-17/h1-4,7-8,11,13H,5-6,9-10,12H2,(H,21,22)(H,23,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5	n/a	n/a	n/a	n/a	n/a	n/a
Celgene Corporation Curated by ChEMBL					Assay Description Inhibition of mTOR				Bioorg Med Chem Lett 21: 6793-9 (2011) Article DOI: 10.1016/j.bmcl.2011.09.035 BindingDB Entry DOI: 10.7270/Q28W3DR1
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50362928 (CHEMBL1945955) Show SMILES O=c1[nH]c2ncc(nc2n1CC1CCOCC1)-c1ccc(cc1)-c1ncc[nH]1 Show InChI InChI=1S/C20H20N6O2/c27-20-25-18-19(26(20)12-13-5-9-28-10-6-13)24-16(11-23-18)14-1-3-15(4-2-14)17-21-7-8-22-17/h1-4,7-8,11,13H,5-6,9-10,12H2,(H,21,22)(H,23,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	55	n/a	n/a	n/a	n/a	n/a	n/a
Celgene Corporation Curated by ChEMBL					Assay Description Inhibition of mTOR-mediated Akt phosphorylation in human PC3 cells				Bioorg Med Chem Lett 21: 6793-9 (2011) Article DOI: 10.1016/j.bmcl.2011.09.035 BindingDB Entry DOI: 10.7270/Q28W3DR1
					More data for this Ligand-Target Pair
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50362928 (CHEMBL1945955) Show SMILES O=c1[nH]c2ncc(nc2n1CC1CCOCC1)-c1ccc(cc1)-c1ncc[nH]1 Show InChI InChI=1S/C20H20N6O2/c27-20-25-18-19(26(20)12-13-5-9-28-10-6-13)24-16(11-23-18)14-1-3-15(4-2-14)17-21-7-8-22-17/h1-4,7-8,11,13H,5-6,9-10,12H2,(H,21,22)(H,23,25,27)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	273	n/a	n/a	n/a	n/a	n/a	n/a
Celgene Corporation Curated by ChEMBL					Assay Description Inhibition of mTOR-mediated S6 phosphorylation in human PC3 cells				Bioorg Med Chem Lett 21: 6793-9 (2011) Article DOI: 10.1016/j.bmcl.2011.09.035 BindingDB Entry DOI: 10.7270/Q28W3DR1
					More data for this Ligand-Target Pair