BDBM50499381 CHEMBL3736275

SMILES: CNC(=O)c1cnc2ccc(cc2c1Nc1ccc(cc1)C(C)(C)C#N)-c1ccc(N)nc1

InChI Key: InChIKey=JYAPCHNVVUXMSX-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 = 50499381   

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))	BDBM50499381 (CHEMBL3736275) Show SMILES CNC(=O)c1cnc2ccc(cc2c1Nc1ccc(cc1)C(C)(C)C#N)-c1ccc(N)nc1 Show InChI InChI=1S/C26H24N6O/c1-26(2,15-27)18-6-8-19(9-7-18)32-24-20-12-16(17-5-11-23(28)31-13-17)4-10-22(20)30-14-21(24)25(33)29-3/h4-14H,1-3H3,(H2,28,31)(H,29,33)(H,30,32)	PDB MMDB NCI pathway Reactome pathway KEGG B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	280	n/a	n/a	n/a	n/a	n/a	n/a
Zhejiang University Curated by ChEMBL					Assay Description Inhibition of mTOR (unknown origin) using ULight-4E-BP1 peptide as substrate after 1 hr by lance ultra assay				Bioorg Med Chem 23: 7585-96 (2015) Article DOI: 10.1016/j.bmc.2015.11.003 BindingDB Entry DOI: 10.7270/Q2HD7ZPM
					More data for this Ligand-Target Pair