BDBM50535177 CHEMBL4469585

SMILES: CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CC#N)c1ccc(N(CC#N)S(=O)(=O)c2ccc(NC(C)=O)cc2)c2ccccc12

InChI Key: InChIKey=PLDIEEXKYQDWLJ-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 = 50535177   

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))	BDBM50535177 (CHEMBL4469585) Show SMILES CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CC#N)c1ccc(N(CC#N)S(=O)(=O)c2ccc(NC(C)=O)cc2)c2ccccc12 Show InChI InChI=1S/C30H26N6O6S2/c1-21(37)33-23-7-11-25(12-8-23)43(39,40)35(19-17-31)29-15-16-30(28-6-4-3-5-27(28)29)36(20-18-32)44(41,42)26-13-9-24(10-14-26)34-22(2)38/h3-16H,19-20H2,1-2H3,(H,33,37)(H,34,38)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
China Pharmaceutical University Curated by ChEMBL					Assay Description Inhibition of Keap1 Kelch domain/FITC-9mer Nrf2 (unknown origin) interaction after 30 mins by fluorescence polarization assay				ACS Med Chem Lett 7: 835-40 (2016) Article DOI: 10.1021/acsmedchemlett.5b00407
					More data for this Ligand-Target Pair