Compile Data Set for Download or QSAR

Found 32 hits Enz. Inhib. hit(s) with all data for entry = 50006913   

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
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504654 (AZL 0 211089 | AZL O 211089 | AZL-0211089 | AZL-O-...) Show SMILES COC(=O)\C=C\C(=O)OC Show InChI InChI=1S/C6H8O4/c1-9-5(7)3-4-6(8)10-2/h3-4H,1-2H3/b4-3+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem	Article PubMed	n/a	n/a	n/a	n/a	5.11E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504684 (CHEMBL4542121) Show SMILES CN(C)C(=O)COc1ccc(cc1)C(=O)\C=C\c1ccccc1C(F)(F)F Show InChI InChI=1S/C20H18F3NO3/c1-24(2)19(26)13-27-16-10-7-15(8-11-16)18(25)12-9-14-5-3-4-6-17(14)20(21,22)23/h3-12H,13H2,1-2H3/b12-9+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.12E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504656 (CHEMBL1549549) Show SMILES CN(C)C(=O)COc1ccc(cc1)C(=O)\C=C\c1cccnc1 Show InChI InChI=1S/C18H18N2O3/c1-20(2)18(22)13-23-16-8-6-15(7-9-16)17(21)10-5-14-4-3-11-19-12-14/h3-12H,13H2,1-2H3/b10-5+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.46E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504657 (CHEMBL4577531) Show SMILES Cl.FC(F)(F)c1ccccc1\C=C\C(=O)c1cccc(OCCCN2CCOCC2)c1 Show InChI InChI=1S/C23H24F3NO3/c24-23(25,26)21-8-2-1-5-18(21)9-10-22(28)19-6-3-7-20(17-19)30-14-4-11-27-12-15-29-16-13-27/h1-3,5-10,17H,4,11-16H2/b10-9+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504658 (CHEMBL4564810) Show SMILES Cl.Clc1ccccc1\C=C\C(=O)c1cccc(OCCCN2CCOCC2)c1 Show InChI InChI=1S/C22H24ClNO3/c23-21-8-2-1-5-18(21)9-10-22(25)19-6-3-7-20(17-19)27-14-4-11-24-12-15-26-16-13-24/h1-3,5-10,17H,4,11-16H2/b10-9+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.84E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504659 (CHEMBL4577533) Show SMILES Cl.FC(F)(F)c1cccc(\C=C\C(=O)c2ccc(OCCCN3CCOCC3)cc2)c1 Show InChI InChI=1S/C23H24F3NO3/c24-23(25,26)20-4-1-3-18(17-20)5-10-22(28)19-6-8-21(9-7-19)30-14-2-11-27-12-15-29-16-13-27/h1,3-10,17H,2,11-16H2/b10-5+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.06E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504660 (CHEMBL4541132) Show SMILES Cl.FC(F)(F)c1ccc(\C=C\C(=O)c2ccc(OCCCN3CCOCC3)cc2)cc1 Show InChI InChI=1S/C23H24F3NO3/c24-23(25,26)20-7-2-18(3-8-20)4-11-22(28)19-5-9-21(10-6-19)30-15-1-12-27-13-16-29-17-14-27/h2-11H,1,12-17H2/b11-4+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.43E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504661 (CHEMBL4521044) Show SMILES Cl.COc1ccccc1\C=C\C(=O)c1ccc(OCCCN2CCOCC2)cc1 Show InChI InChI=1S/C23H27NO4/c1-26-23-6-3-2-5-20(23)9-12-22(25)19-7-10-21(11-8-19)28-16-4-13-24-14-17-27-18-15-24/h2-3,5-12H,4,13-18H2,1H3/b12-9+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.63E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504662 (CHEMBL4522957) Show SMILES Cl.O=C(\C=C\c1ccccn1)c1ccc(OCCCN2CCOCC2)cc1 Show InChI InChI=1S/C21H24N2O3/c24-21(10-7-19-4-1-2-11-22-19)18-5-8-20(9-6-18)26-15-3-12-23-13-16-25-17-14-23/h1-2,4-11H,3,12-17H2/b10-7+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504663 (CHEMBL4470401) Show SMILES Cl.O=C(\C=C\c1cccnc1)c1ccc(OCCCN2CCOCC2)cc1 Show InChI InChI=1S/C21H24N2O3/c24-21(9-4-18-3-1-10-22-17-18)19-5-7-20(8-6-19)26-14-2-11-23-12-15-25-16-13-23/h1,3-10,17H,2,11-16H2/b9-4+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>5.00E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504664 (CHEMBL4450274) Show SMILES Cl.COc1ccccc1\C=C\C(=O)c1ccc(OCCCN2CCCC2)cc1 Show InChI InChI=1S/C23H27NO3/c1-26-23-8-3-2-7-20(23)11-14-22(25)19-9-12-21(13-10-19)27-18-6-17-24-15-4-5-16-24/h2-3,7-14H,4-6,15-18H2,1H3/b14-11+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	990	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504665 (CHEMBL4460937) Show SMILES Cl.Cl.COc1ccccc1\C=C\C(=O)c1ccc(OCCCN2CCN(C)CC2)cc1 Show InChI InChI=1S/C24H30N2O3/c1-25-15-17-26(18-16-25)14-5-19-29-22-11-8-20(9-12-22)23(27)13-10-21-6-3-4-7-24(21)28-2/h3-4,6-13H,5,14-19H2,1-2H3/b13-10+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	3.33E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504666 (CHEMBL4472361) Show SMILES COc1ccccc1\C=C\C(=O)c1ccc(OCC(=O)N(C)C)cc1 Show InChI InChI=1S/C20H21NO4/c1-21(2)20(23)14-25-17-11-8-15(9-12-17)18(22)13-10-16-6-4-5-7-19(16)24-3/h4-13H,14H2,1-3H3/b13-10+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.46E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504667 (CHEMBL4447888) Show SMILES CN(C)C(=O)COc1ccc(cc1)C(=O)\C=C\c1ccncc1 Show InChI InChI=1S/C18H18N2O3/c1-20(2)18(22)13-23-16-6-4-15(5-7-16)17(21)8-3-14-9-11-19-12-10-14/h3-12H,13H2,1-2H3/b8-3+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.36E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504668 (CHEMBL4444134) Show SMILES FC(F)(F)c1ccccc1\C=C\C(=O)c1ccc(OCC(=O)N2CCOCC2)cc1 Show InChI InChI=1S/C22H20F3NO4/c23-22(24,25)19-4-2-1-3-16(19)7-10-20(27)17-5-8-18(9-6-17)30-15-21(28)26-11-13-29-14-12-26/h1-10H,11-15H2/b10-7+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.06E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504669 (CHEMBL4532883) Show SMILES COc1ccccc1\C=C\C(=O)c1ccc(OCC(=O)N2CCOCC2)cc1 Show InChI InChI=1S/C22H23NO5/c1-26-21-5-3-2-4-18(21)8-11-20(24)17-6-9-19(10-7-17)28-16-22(25)23-12-14-27-15-13-23/h2-11H,12-16H2,1H3/b11-8+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.77E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504670 (CHEMBL4448994) Show SMILES Cl.COc1ccccc1\C=C\C(=O)c1ccc(OCC(=O)N2CCN(C)CC2)cc1 Show InChI InChI=1S/C23H26N2O4/c1-24-13-15-25(16-14-24)23(27)17-29-20-10-7-18(8-11-20)21(26)12-9-19-5-3-4-6-22(19)28-2/h3-12H,13-17H2,1-2H3/b12-9+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.91E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504671 (CHEMBL4441857) Show SMILES Cl.CN1CCN(CC1)C(=O)COc1ccc(cc1)C(=O)\C=C\c1ccccc1Cl Show InChI InChI=1S/C22H23ClN2O3/c1-24-12-14-25(15-13-24)22(27)16-28-19-9-6-18(7-10-19)21(26)11-8-17-4-2-3-5-20(17)23/h2-11H,12-16H2,1H3/b11-8+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	970	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504672 (CHEMBL4536089) Show SMILES Cl.COc1ccccc1\C=C\C(=O)c1ccccc1OCCCN1CCOCC1 Show InChI InChI=1S/C23H27NO4/c1-26-22-9-4-2-7-19(22)11-12-21(25)20-8-3-5-10-23(20)28-16-6-13-24-14-17-27-18-15-24/h2-5,7-12H,6,13-18H2,1H3/b12-11+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	5.52E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504673 (CHEMBL4590580) Show SMILES Cl.FC(F)(F)c1ccccc1\C=C\C(=O)c1ccc(OCCCN2CCOCC2)cc1 Show InChI InChI=1S/C23H24F3NO3/c24-23(25,26)21-5-2-1-4-18(21)8-11-22(28)19-6-9-20(10-7-19)30-15-3-12-27-13-16-29-17-14-27/h1-2,4-11H,3,12-17H2/b11-8+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.36E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504674 (CHEMBL4469824) Show SMILES Cl.COc1cccc(\C=C\C(=O)c2ccc(OCCCN3CCOCC3)cc2)c1 Show InChI InChI=1S/C23H27NO4/c1-26-22-5-2-4-19(18-22)6-11-23(25)20-7-9-21(10-8-20)28-15-3-12-24-13-16-27-17-14-24/h2,4-11,18H,3,12-17H2,1H3/b11-6+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.58E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504675 (CHEMBL4440458) Show SMILES Cl.Clc1ccccc1\C=C\C(=O)c1ccc(OCCCN2CCCC2)cc1 Show InChI InChI=1S/C22H24ClNO2/c23-21-7-2-1-6-18(21)10-13-22(25)19-8-11-20(12-9-19)26-17-5-16-24-14-3-4-15-24/h1-2,6-13H,3-5,14-17H2/b13-10+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.39E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504676 (CHEMBL4449601) Show SMILES CN(C)C(=O)COc1ccc(cc1)C(=O)\C=C\c1ccccn1 Show InChI InChI=1S/C18H18N2O3/c1-20(2)18(22)13-23-16-9-6-14(7-10-16)17(21)11-8-15-5-3-4-12-19-15/h3-12H,13H2,1-2H3/b11-8+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.10E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504677 (CHEMBL4459946) Show SMILES Cl.CN1CCN(CC1)C(=O)COc1ccc(cc1)C(=O)\C=C\c1ccccc1C(F)(F)F Show InChI InChI=1S/C23H23F3N2O3/c1-27-12-14-28(15-13-27)22(30)16-31-19-9-6-18(7-10-19)21(29)11-8-17-4-2-3-5-20(17)23(24,25)26/h2-11H,12-16H2,1H3/b11-8+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	630	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50073654 (4-(Methylsulfinyl)Butyl Isothiocyanate | CHEBI:478...) Show SMILES C[S+]([O-])CCCCN=C=S Show InChI InChI=1S/C6H11NOS2/c1-10(8)5-3-2-4-7-6-9/h2-5H2,1H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	870	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504678 (CHEMBL4526218) Show SMILES Cl.FC(F)(F)c1ccccc1\C=C\C(=O)c1ccc(OCCCN2CCCC2)cc1 Show InChI InChI=1S/C23H24F3NO2/c24-23(25,26)21-7-2-1-6-18(21)10-13-22(28)19-8-11-20(12-9-19)29-17-5-16-27-14-3-4-15-27/h1-2,6-13H,3-5,14-17H2/b13-10+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	>1.00E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504679 (CHEMBL4569049) Show SMILES Cl.COc1ccccc1\C=C\C(=O)c1cccc(OCCCN2CCOCC2)c1 Show InChI InChI=1S/C23H27NO4/c1-26-23-9-3-2-6-19(23)10-11-22(25)20-7-4-8-21(18-20)28-15-5-12-24-13-16-27-17-14-24/h2-4,6-11,18H,5,12-17H2,1H3/b11-10+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.72E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504680 (CHEMBL4524361) Show SMILES Clc1ccccc1\C=C\C(=O)c1ccc(OCCCN2CCOCC2)cc1 Show InChI InChI=1S/C22H24ClNO3/c23-21-5-2-1-4-18(21)8-11-22(25)19-6-9-20(10-7-19)27-15-3-12-24-13-16-26-17-14-24/h1-2,4-11H,3,12-17H2/b11-8+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	2.42E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504681 (CHEMBL4468628) Show SMILES O=C(COc1ccc(cc1)C(=O)\C=C\c1ccccn1)N1CCOCC1 Show InChI InChI=1S/C20H20N2O4/c23-19(9-6-17-3-1-2-10-21-17)16-4-7-18(8-5-16)26-15-20(24)22-11-13-25-14-12-22/h1-10H,11-15H2/b9-6+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.23E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504682 (CHEMBL4557962) Show SMILES Cl.CN1CCN(CC1)C(=O)COc1ccc(cc1)C(=O)\C=C\c1ccccc1 Show InChI InChI=1S/C22H24N2O3/c1-23-13-15-24(16-14-23)22(26)17-27-20-10-8-19(9-11-20)21(25)12-7-18-5-3-2-4-6-18/h2-12H,13-17H2,1H3/b12-7+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504683 (CHEMBL4469160) Show SMILES Cl.CN1CCN(CC1)C(=O)COc1ccc(cc1)C(=O)\C=C\c1ccccc1F Show InChI InChI=1S/C22H23FN2O3/c1-24-12-14-25(15-13-24)22(27)16-28-19-9-6-18(7-10-19)21(26)11-8-17-4-2-3-5-20(17)23/h2-11H,12-16H2,1H3/b11-8+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	1.54E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50504655 (CHEMBL4557915) Show SMILES Cl.COc1ccc(\C=C\C(=O)c2ccc(OCCCN3CCOCC3)cc2)cc1 Show InChI InChI=1S/C23H27NO4/c1-26-21-8-3-19(4-9-21)5-12-23(25)20-6-10-22(11-7-20)28-16-2-13-24-14-17-27-18-15-24/h3-12H,2,13-18H2,1H3/b12-5+	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	n/a	n/a	6.97E+3	n/a	n/a	n/a	n/a
Korea Institute of Science and Technology (KIST) Curated by ChEMBL					Assay Description Activation of NRF2 in human U2OS cells co-expressing Keap1 (unknown origin) assessed as induction of NRF2 translocation to nucleus incubated for 6 hr...				Eur J Med Chem 185: (2020) Article DOI: 10.1016/j.ejmech.2019.111777 BindingDB Entry DOI: 10.7270/Q26976TG
					More data for this Ligand-Target Pair