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

InChI Key: InChIKey=YEVUHROYYXHXIT-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50535173   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Nuclear factor erythroid 2-related factor 2


(Homo sapiens (Human))		BDBM50535173
PNG
(CHEMBL4592064)
Show SMILES CC(=O)Nc1ccc(cc1)S(=O)(=O)N(CC(N)=O)c1ccc(N(CC(N)=O)S(=O)(=O)c2ccc(NC(C)=O)cc2)c2ccccc12
Show InChI InChI=1S/C30H30N6O8S2/c1-19(37)33-21-7-11-23(12-8-21)45(41,42)35(17-29(31)39)27-15-16-28(26-6-4-3-5-25(26)27)36(18-30(32)40)46(43,44)24-13-9-22(10-14-24)34-20(2)38/h3-16H,17-18H2,1-2H3,(H2,31,39)(H2,32,40)(H,33,37)(H,34,38)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>5.00E+4n/an/an/an/an/an/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