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SMILES: CO[C@]1(CC2(CC2)C(=O)C(=C1)C#N)c1ncccc1C(F)F

InChI Key: InChIKey=GTNVTONZQZYADB-MRXNPFEDSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50502726   
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
Kelch-like ECH-associated protein 1


(Homo sapiens (Human))		BDBM50502726
PNG
(CHEMBL4583328)
Show SMILES CO[C@]1(CC2(CC2)C(=O)C(=C1)C#N)c1ncccc1C(F)F |r,c:10|
Show InChI InChI=1S/C16H14F2N2O2/c1-22-16(12-11(14(17)18)3-2-6-20-12)7-10(8-19)13(21)15(9-16)4-5-15/h2-3,6-7,14H,4-5,9H2,1H3/t16-/m1/s1
PDB
MMDB

KEGG

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PC cid
PC sid
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Article
PubMed
n/an/an/an/a 14n/an/an/an/a



Temple University School of Pharmacy

Curated by ChEMBL


Assay Description
Inhibition of KEAP1 interaction with Nrf2 in human HEK293 cells transfected with ARE-LUC assessed as activation of Nrf2 signaling pathway measured af...

ACS Med Chem Lett 10: 1245-1246 (2019)


Article DOI: 10.1021/acsmedchemlett.9b00328
More data for this
Ligand-Target Pair