null

SMILES: Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)NCc1cccnc1

InChI Key: InChIKey=AWYQPFBZFZNCSS-UHBFCERESA-N

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50314338   

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
Serine/threonine-protein kinase mTOR (Homo sapiens (Human))	BDBM50314338 ((Z)-1-(1-methyl-3-((3-oxo-5-(3-pyridin-3-ylureido)...) Show SMILES Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C35H32N8O4/c1-42-21-24(16-30-32(44)27-17-25(6-7-29(27)47-30)40-35(46)41-26-5-3-12-37-20-26)31-28(8-13-38-33(31)42)43-14-9-23(10-15-43)34(45)39-19-22-4-2-11-36-18-22/h2-8,11-13,16-18,20-21,23H,9-10,14-15,19H2,1H3,(H,39,45)(H2,40,41,46)/b30-16-	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	9	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of mTOR				Bioorg Med Chem Lett 20: 2259-63 (2010) Article DOI: 10.1016/j.bmcl.2010.02.012 BindingDB Entry DOI: 10.7270/Q2TB1717
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50314338 ((Z)-1-(1-methyl-3-((3-oxo-5-(3-pyridin-3-ylureido)...) Show SMILES Cn1cc(\C=C2/Oc3ccc(NC(=O)Nc4cccnc4)cc3C2=O)c2c(ccnc12)N1CCC(CC1)C(=O)NCc1cccnc1 Show InChI InChI=1S/C35H32N8O4/c1-42-21-24(16-30-32(44)27-17-25(6-7-29(27)47-30)40-35(46)41-26-5-3-12-37-20-26)31-28(8-13-38-33(31)42)43-14-9-23(10-15-43)34(45)39-19-22-4-2-11-36-18-22/h2-8,11-13,16-18,20-21,23H,9-10,14-15,19H2,1H3,(H,39,45)(H2,40,41,46)/b30-16-	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	4.04E+3	n/a	n/a	n/a	n/a	n/a	n/a
Wyeth Research Curated by ChEMBL					Assay Description Inhibition of PI3Kalpha				Bioorg Med Chem Lett 20: 2259-63 (2010) Article DOI: 10.1016/j.bmcl.2010.02.012 BindingDB Entry DOI: 10.7270/Q2TB1717
					More data for this Ligand-Target Pair