BDBM50508493 CHEMBL4554978

SMILES: CN1CCC(CC1)SC(=S)NCCCCNC(=O)CC1CCCCC1

InChI Key: InChIKey=WZVPMPRAKITESJ-UHFFFAOYSA-N

Data: 1 IC50

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Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50508493   

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
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50508493 (CHEMBL4554978) Show SMILES CN1CCC(CC1)SC(=S)NCCCCNC(=O)CC1CCCCC1 Show InChI InChI=1S/C19H35N3OS2/c1-22-13-9-17(10-14-22)25-19(24)21-12-6-5-11-20-18(23)15-16-7-3-2-4-8-16/h16-17H,2-15H2,1H3,(H,20,23)(H,21,24)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.58E+4	n/a	n/a	n/a	n/a	n/a	n/a
GlaxoSmithKline Curated by ChEMBL					Assay Description Binding affinity to FLAG/His-tagged Keap1 (unknown origin)/biotinylated full-length FLAG/His/Tev/Avi-tagged NRF2 (unknown origin) expressed in baculo...				Bioorg Med Chem 27: 579-588 (2019) Article DOI: 10.1016/j.bmc.2018.12.026
					More data for this Ligand-Target Pair