BDBM50362919 CHEMBL1945797

SMILES: OC(=O)c1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1

InChI Key: InChIKey=LQYQBSQPJJZUBK-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 = 50362919   

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 (Homo sapiens (Human))	BDBM50362919 (CHEMBL1945797) Show SMILES OC(=O)c1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1 Show InChI InChI=1S/C19H20N4O3/c24-18(25)14-8-6-13(7-9-14)15-10-20-16-17(21-15)23(19(26)22-16)11-12-4-2-1-3-5-12/h6-10,12H,1-5,11H2,(H,24,25)(H,20,22,26)	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	2.35E+4	n/a	n/a	n/a	n/a	n/a	n/a
Celgene Corporation Curated by ChEMBL					Assay Description Inhibition of PI3Kalpha				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))	BDBM50362919 (CHEMBL1945797) Show SMILES OC(=O)c1ccc(cc1)-c1cnc2[nH]c(=O)n(CC3CCCCC3)c2n1 Show InChI InChI=1S/C19H20N4O3/c24-18(25)14-8-6-13(7-9-14)15-10-20-16-17(21-15)23(19(26)22-16)11-12-4-2-1-3-5-12/h6-10,12H,1-5,11H2,(H,24,25)(H,20,22,26)	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	130	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