BDBM50243924 CHEMBL4075931

SMILES: NC(=O)CN1CCC(CC1)n1c2c(cnc3ccc(cc23)-c2ccc(N)nc2)ncc1=O

InChI Key: InChIKey=FYHJSXVIDYMDGB-UHFFFAOYSA-N

Data: 1 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 1 hit for monomerid = 50243924   

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))	BDBM50243924 (CHEMBL4075931) Show SMILES NC(=O)CN1CCC(CC1)n1c2c(cnc3ccc(cc23)-c2ccc(N)nc2)ncc1=O Show InChI InChI=1S/C23H23N7O2/c24-20-4-2-15(10-28-20)14-1-3-18-17(9-14)23-19(11-26-18)27-12-22(32)30(23)16-5-7-29(8-6-16)13-21(25)31/h1-4,9-12,16H,5-8,13H2,(H2,24,28)(H2,25,31)	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	3	n/a	n/a	n/a	n/a	n/a	n/a
Nankai University Curated by ChEMBL					Assay Description Inhibition of N-terminal FLAG-tagged recombinant human mTOR (1362 to end residues)				J Med Chem 61: 881-904 (2018) Article DOI: 10.1021/acs.jmedchem.7b01402 BindingDB Entry DOI: 10.7270/Q28K7CHW
					More data for this Ligand-Target Pair