Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kelch-like ECH-associated protein 1' and Ligand = 'BDBM50502723'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Kelch-like ECH-associated protein 1 (Homo sapiens (Human))	BDBM50502723 (CHEMBL4462699 | US11479539, Compound 196) Show SMILES COC1(CC2(CC2)C(=O)C(=C1)C#N)c1ncc(F)cc1C(F)F |c:10| Show InChI InChI=1S/C16H13F3N2O2/c1-23-16(12-11(14(18)19)4-10(17)7-21-12)5-9(6-20)13(22)15(8-16)2-3-15/h4-5,7,14H,2-3,8H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	18	n/a	n/a	n/a	n/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 BindingDB Entry DOI: 10.7270/Q2QZ2F72
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