BDBM50396319 CHEMBL2172632

SMILES: Cc1nc(Nc2cccnn2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12

InChI Key: InChIKey=RHLKAAGLEWHOFV-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 = 50396319   

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))	BDBM50396319 (CHEMBL2172632) Show SMILES Cc1nc(Nc2cccnn2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12 Show InChI InChI=1S/C18H15N11/c1-11-22-12(10-15(23-11)24-13-4-2-7-19-27-13)17-18(25-14-6-9-20-28-14)26-16-5-3-8-21-29(16)17/h2-10H,1H3,(H2,20,25,28)(H,22,23,24,27)	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	24	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of mTOR by LanthaScreen assay				Bioorg Med Chem Lett 22: 4967-74 (2012) Article DOI: 10.1016/j.bmcl.2012.06.033 BindingDB Entry DOI: 10.7270/Q2BK1DHN
					More data for this Ligand-Target Pair
Phosphatidylinositol 4,5-bisphosphate 3-kinase catalytic subunit alpha isoform (Homo sapiens (Human))	BDBM50396319 (CHEMBL2172632) Show SMILES Cc1nc(Nc2cccnn2)cc(n1)-c1c(Nc2ccn[nH]2)nc2cccnn12 Show InChI InChI=1S/C18H15N11/c1-11-22-12(10-15(23-11)24-13-4-2-7-19-27-13)17-18(25-14-6-9-20-28-14)26-16-5-3-8-21-29(16)17/h2-10H,1H3,(H2,20,25,28)(H,22,23,24,27)	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	173	n/a	n/a	n/a	n/a	n/a	n/a
Amgen Inc. Curated by ChEMBL					Assay Description Inhibition of PI3Kalpha by AlphaScreen assay				Bioorg Med Chem Lett 22: 4967-74 (2012) Article DOI: 10.1016/j.bmcl.2012.06.033 BindingDB Entry DOI: 10.7270/Q2BK1DHN
					More data for this Ligand-Target Pair