Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Kelch-like ECH-associated protein 1' and Ligand = 'BDBM50190586'   

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))	BDBM50190586 (CHEMBL3827061) Show SMILES Cc1nc(sc1S(=O)(=O)Nc1ccc(N2CC[C@H](C2)C(O)=O)c2ccccc12)-c1ccccc1 |r| Show InChI InChI=1S/C25H23N3O4S2/c1-16-25(33-23(26-16)17-7-3-2-4-8-17)34(31,32)27-21-11-12-22(20-10-6-5-9-19(20)21)28-14-13-18(15-28)24(29)30/h2-12,18,27H,13-15H2,1H3,(H,29,30)/t18-/m1/s1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	400	n/a	n/a	n/a	n/a	n/a	n/a
Therachem Research Medilab (India) Pvt. Ltd. Curated by ChEMBL					Assay Description Inhibition of human Keap1 kelch domain (Ala321 to Thr609 residues) binding to fluorescent labeled Nrf2 peptide preincubated for 15 mins followed by N...				ACS Med Chem Lett 7: 660-1 (2016) Article DOI: 10.1021/acsmedchemlett.6b00181 BindingDB Entry DOI: 10.7270/Q2J96899
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