Compile Data Set for Download or QSAR

Found 49 hits with Last Name = 'imamura' and Initial = 'r'   

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
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162967 (CHEMBL3792850) Show SMILES O=C(Nc1ccc(CN2CCN(CC2)c2ccccc2)cc1)c1n[nH]c2ccccc12 Show InChI InChI=1S/C25H25N5O/c31-25(24-22-8-4-5-9-23(22)27-28-24)26-20-12-10-19(11-13-20)18-29-14-16-30(17-15-29)21-6-2-1-3-7-21/h1-13H,14-18H2,(H,26,31)(H,27,28)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using fluorescence...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162967 (CHEMBL3792850) Show SMILES O=C(Nc1ccc(CN2CCN(CC2)c2ccccc2)cc1)c1n[nH]c2ccccc12 Show InChI InChI=1S/C25H25N5O/c31-25(24-22-8-4-5-9-23(22)27-28-24)26-20-12-10-19(11-13-20)18-29-14-16-30(17-15-29)21-6-2-1-3-7-21/h1-13H,14-18H2,(H,26,31)(H,27,28)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	10	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162968 (CHEMBL3793843) Show SMILES O=C(Nc1ccc(cc1)C(=O)N1CCN(CC1)c1ccccc1)c1n[nH]c2ccccc12 Show InChI InChI=1S/C25H23N5O2/c31-24(23-21-8-4-5-9-22(21)27-28-23)26-19-12-10-18(11-13-19)25(32)30-16-14-29(15-17-30)20-6-2-1-3-7-20/h1-13H,14-17H2,(H,26,31)(H,27,28)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using fluorescence...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162968 (CHEMBL3793843) Show SMILES O=C(Nc1ccc(cc1)C(=O)N1CCN(CC1)c1ccccc1)c1n[nH]c2ccccc12 Show InChI InChI=1S/C25H23N5O2/c31-24(23-21-8-4-5-9-22(21)27-28-23)26-19-12-10-18(11-13-19)25(32)30-16-14-29(15-17-30)20-6-2-1-3-7-20/h1-13H,14-17H2,(H,26,31)(H,27,28)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	34	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162971 (CHEMBL3793804) Show SMILES O=C(OCc1ccccc1)N1CCN(CC1)C(=O)c1ccc(NC(=O)c2n[nH]c3ccccc23)cc1 Show InChI InChI=1S/C27H25N5O4/c33-25(24-22-8-4-5-9-23(22)29-30-24)28-21-12-10-20(11-13-21)26(34)31-14-16-32(17-15-31)27(35)36-18-19-6-2-1-3-7-19/h1-13H,14-18H2,(H,28,33)(H,29,30)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	42	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50163005 (CHEMBL3793847) Show SMILES CN(C)C(=O)N1CCN(CC1)C(=O)c1ccc(NC(=O)c2n[nH]c3ccccc23)cc1 Show InChI InChI=1S/C22H24N6O3/c1-26(2)22(31)28-13-11-27(12-14-28)21(30)15-7-9-16(10-8-15)23-20(29)19-17-5-3-4-6-18(17)24-25-19/h3-10H,11-14H2,1-2H3,(H,23,29)(H,24,25)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	43	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50163003 (CHEMBL3793427) Show SMILES CCOC(=O)N1CCN(CC1)C(=O)c1ccc(NC(=O)c2n[nH]c3ccccc23)cc1 Show InChI InChI=1S/C22H23N5O4/c1-2-31-22(30)27-13-11-26(12-14-27)21(29)15-7-9-16(10-8-15)23-20(28)19-17-5-3-4-6-18(17)24-25-19/h3-10H,2,11-14H2,1H3,(H,23,28)(H,24,25)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	46	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162970 (CHEMBL3792973) Show SMILES O=C(Nc1ccc(cc1)C(=O)N1CCN(CC1)C(c1ccccc1)c1ccccc1)c1n[nH]c2ccccc12 Show InChI InChI=1S/C32H29N5O2/c38-31(29-27-13-7-8-14-28(27)34-35-29)33-26-17-15-25(16-18-26)32(39)37-21-19-36(20-22-37)30(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-18,30H,19-22H2,(H,33,38)(H,34,35)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	56	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50163011 (CHEMBL3794211) Show SMILES O=C(Nc1ccc(cc1)C(=O)N1CCNCC1)c1n[nH]c2ccccc12 Show InChI InChI=1S/C19H19N5O2/c25-18(17-15-3-1-2-4-16(15)22-23-17)21-14-7-5-13(6-8-14)19(26)24-11-9-20-10-12-24/h1-8,20H,9-12H2,(H,21,25)(H,22,23)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	61	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50163007 (CHEMBL3793695) Show SMILES CN1CCN(CC1)C(=O)c1ccc(NC(=O)c2n[nH]c3ccccc23)cc1 Show InChI InChI=1S/C20H21N5O2/c1-24-10-12-25(13-11-24)20(27)14-6-8-15(9-7-14)21-19(26)18-16-4-2-3-5-17(16)22-23-18/h2-9H,10-13H2,1H3,(H,21,26)(H,22,23)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	90	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50163009 (CHEMBL3792878) Show SMILES O=C(Nc1ccc(cc1)C(=O)N1CCOCC1)c1n[nH]c2ccccc12 Show InChI InChI=1S/C19H18N4O3/c24-18(17-15-3-1-2-4-16(15)21-22-17)20-14-7-5-13(6-8-14)19(25)23-9-11-26-12-10-23/h1-8H,9-12H2,(H,20,24)(H,21,22)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	95	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50163030 (CHEMBL3792955) Show SMILES CCN(CC)C(=O)c1ccc(NC(=O)c2n[nH]c3ccccc23)cc1 Show InChI InChI=1S/C19H20N4O2/c1-3-23(4-2)19(25)13-9-11-14(12-10-13)20-18(24)17-15-7-5-6-8-16(15)21-22-17/h5-12H,3-4H2,1-2H3,(H,20,24)(H,21,22)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	107	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50163032 (CHEMBL3793933) Show SMILES CN(C)C(=O)c1ccc(NC(=O)c2n[nH]c3ccccc23)cc1 Show InChI InChI=1S/C17H16N4O2/c1-21(2)17(23)11-7-9-12(10-8-11)18-16(22)15-13-5-3-4-6-14(13)19-20-15/h3-10H,1-2H3,(H,18,22)(H,19,20)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	110	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50163022 (CHEMBL3794503) Show SMILES O=C(Nc1ccc(cc1)C(=O)N1CCCCC1)c1n[nH]c2ccccc12 Show InChI InChI=1S/C20H20N4O2/c25-19(18-16-6-2-3-7-17(16)22-23-18)21-15-10-8-14(9-11-15)20(26)24-12-4-1-5-13-24/h2-3,6-11H,1,4-5,12-13H2,(H,21,25)(H,22,23)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	113	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
High affinity nerve growth factor receptor (Homo sapiens (Human))	BDBM50162967 (CHEMBL3792850) Show SMILES O=C(Nc1ccc(CN2CCN(CC2)c2ccccc2)cc1)c1n[nH]c2ccccc12 Show InChI InChI=1S/C25H25N5O/c31-25(24-22-8-4-5-9-23(22)27-28-24)26-20-12-10-19(11-13-20)18-29-14-16-30(17-15-29)21-6-2-1-3-7-21/h1-13H,14-18H2,(H,26,31)(H,27,28)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	137	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged TRKA cytoplasmic domain (436 to 790 residues) expressed in baculovirus expression system using fluorescence...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50205342 (CHEMBL3962296) Show SMILES CCOc1ccc(cc1)S(=O)(=O)Nc1cc(CCCC(O)=O)c(NS(=O)(=O)c2ccc(OCC)cc2)c2ccccc12 Show InChI InChI=1S/C30H32N2O8S2/c1-3-39-22-12-16-24(17-13-22)41(35,36)31-28-20-21(8-7-11-29(33)34)30(27-10-6-5-9-26(27)28)32-42(37,38)25-18-14-23(15-19-25)40-4-2/h5-6,9-10,12-20,31-32H,3-4,7-8,11H2,1-2H3,(H,33,34)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	150	n/a	n/a	n/a	n/a	n/a	n/a
Keio University Curated by ChEMBL					Assay Description Inhibition of recombinant GST-His-tagged Keap1-DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli/FAM-labeled Nrf2 (unkno...				Bioorg Med Chem Lett 26: 5956-5959 (2016) Article DOI: 10.1016/j.bmcl.2016.10.083 BindingDB Entry DOI: 10.7270/Q2PC34CB
					More data for this Ligand-Target Pair
Kelch-like ECH-associated protein 1 (Homo sapiens (Human))	BDBM50262959 (CHEMBL4083845) Show SMILES CCOc1ccc(cc1)S(=O)(=O)Nc1cc2c(C(=O)NN)c(C)n(c2c2ccccc12)S(=O)(=O)c1ccc(OCC)cc1 Show InChI InChI=1S/C30H30N4O7S2/c1-4-40-20-10-14-22(15-11-20)42(36,37)33-27-18-26-28(30(35)32-31)19(3)34(29(26)25-9-7-6-8-24(25)27)43(38,39)23-16-12-21(13-17-23)41-5-2/h6-18,33H,4-5,31H2,1-3H3,(H,32,35)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Department of Pharmaceutical Sciences, Faculty of Pharmacy, Keio University, 1-5-30 Shibakoen, Minato-ku, Tokyo, Japan. Curated by ChEMBL					Assay Description Binding affinity to His-tagged Keap1 DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli assessed as reduction in protein ...				Bioorg Med Chem Lett 27: 5006-5009 (2017) Article DOI: 10.1016/j.bmcl.2017.10.008 BindingDB Entry DOI: 10.7270/Q2T15634
					More data for this Ligand-Target Pair
Kelch-like ECH-associated protein 1 (Homo sapiens (Human))	BDBM50262960 (CHEMBL4099355) Show SMILES COc1ccc(NNC(=O)c2c(C)n(c3c2cc(NS(=O)(=O)c2ccc(OC)cc2)c2ccccc32)S(=O)(=O)c2ccc(OC)cc2)cc1 Show InChI InChI=1S/C35H32N4O8S2/c1-22-33(35(40)37-36-23-9-11-24(45-2)12-10-23)31-21-32(38-48(41,42)27-17-13-25(46-3)14-18-27)29-7-5-6-8-30(29)34(31)39(22)49(43,44)28-19-15-26(47-4)16-20-28/h5-21,36,38H,1-4H3,(H,37,40)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	170	n/a	n/a	n/a	n/a	n/a	n/a
Department of Pharmaceutical Sciences, Faculty of Pharmacy, Keio University, 1-5-30 Shibakoen, Minato-ku, Tokyo, Japan. Curated by ChEMBL					Assay Description Binding affinity to His-tagged Keap1 DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli assessed as reduction in protein ...				Bioorg Med Chem Lett 27: 5006-5009 (2017) Article DOI: 10.1016/j.bmcl.2017.10.008 BindingDB Entry DOI: 10.7270/Q2T15634
					More data for this Ligand-Target Pair
Kelch-like ECH-associated protein 1 (Homo sapiens (Human))	BDBM50262957 (CHEMBL4091619) Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1cc2c(C(=O)NNc3ccccc3)c(C)n(c2c2ccccc12)S(=O)(=O)c1ccc(OC)cc1 Show InChI InChI=1S/C34H30N4O7S2/c1-22-32(34(39)36-35-23-9-5-4-6-10-23)30-21-31(37-46(40,41)26-17-13-24(44-2)14-18-26)28-11-7-8-12-29(28)33(30)38(22)47(42,43)27-19-15-25(45-3)16-20-27/h4-21,35,37H,1-3H3,(H,36,39)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	180	n/a	n/a	n/a	n/a	n/a	n/a
Department of Pharmaceutical Sciences, Faculty of Pharmacy, Keio University, 1-5-30 Shibakoen, Minato-ku, Tokyo, Japan. Curated by ChEMBL					Assay Description Binding affinity to His-tagged Keap1 DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli assessed as reduction in protein ...				Bioorg Med Chem Lett 27: 5006-5009 (2017) Article DOI: 10.1016/j.bmcl.2017.10.008 BindingDB Entry DOI: 10.7270/Q2T15634
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50205336 (CHEMBL3925906) Show SMILES CCOc1ccc(cc1)S(=O)(=O)Nc1cc(SCC(O)=O)c(NS(=O)(=O)c2ccc(OCC)cc2)c2ccccc12 Show InChI InChI=1S/C28H28N2O8S3/c1-3-37-19-9-13-21(14-10-19)40(33,34)29-25-17-26(39-18-27(31)32)28(24-8-6-5-7-23(24)25)30-41(35,36)22-15-11-20(12-16-22)38-4-2/h5-17,29-30H,3-4,18H2,1-2H3,(H,31,32)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Keio University Curated by ChEMBL					Assay Description Inhibition of recombinant GST-His-tagged Keap1-DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli/FAM-labeled Nrf2 (unkno...				Bioorg Med Chem Lett 26: 5956-5959 (2016) Article DOI: 10.1016/j.bmcl.2016.10.083 BindingDB Entry DOI: 10.7270/Q2PC34CB
					More data for this Ligand-Target Pair
Kelch-like ECH-associated protein 1 (Homo sapiens (Human))	BDBM50262955 (CHEMBL4077198) Show SMILES CCOc1ccc(cc1)S(=O)(=O)Nc1cc2c(C(=O)NO)c(C)n(c2c2ccccc12)S(=O)(=O)c1ccc(OCC)cc1 Show InChI InChI=1S/C30H29N3O8S2/c1-4-40-20-10-14-22(15-11-20)42(36,37)32-27-18-26-28(30(34)31-35)19(3)33(29(26)25-9-7-6-8-24(25)27)43(38,39)23-16-12-21(13-17-23)41-5-2/h6-18,32,35H,4-5H2,1-3H3,(H,31,34)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	200	n/a	n/a	n/a	n/a	n/a	n/a
Department of Pharmaceutical Sciences, Faculty of Pharmacy, Keio University, 1-5-30 Shibakoen, Minato-ku, Tokyo, Japan. Curated by ChEMBL					Assay Description Binding affinity to His-tagged Keap1 DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli assessed as reduction in protein ...				Bioorg Med Chem Lett 27: 5006-5009 (2017) Article DOI: 10.1016/j.bmcl.2017.10.008 BindingDB Entry DOI: 10.7270/Q2T15634
					More data for this Ligand-Target Pair
Kelch-like ECH-associated protein 1 (Homo sapiens (Human))	BDBM50006932 (CHEMBL3237245) Show SMILES COc1ccc(cc1)S(=O)(=O)N(CC(O)=O)c1ccc(N(CC(O)=O)S(=O)(=O)c2ccc(OC)cc2)c2ccccc12 Show InChI InChI=1S/C28H26N2O10S2/c1-39-19-7-11-21(12-8-19)41(35,36)29(17-27(31)32)25-15-16-26(24-6-4-3-5-23(24)25)30(18-28(33)34)42(37,38)22-13-9-20(40-2)10-14-22/h3-16H,17-18H2,1-2H3,(H,31,32)(H,33,34)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Department of Pharmaceutical Sciences, Faculty of Pharmacy, Keio University, 1-5-30 Shibakoen, Minato-ku, Tokyo, Japan. Curated by ChEMBL					Assay Description Binding affinity to His-tagged Keap1 DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli assessed as reduction in protein ...				Bioorg Med Chem Lett 27: 5006-5009 (2017) Article DOI: 10.1016/j.bmcl.2017.10.008 BindingDB Entry DOI: 10.7270/Q2T15634
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50205341 (CHEMBL3928944) Show SMILES CCOc1ccc(cc1)S(=O)(=O)Nc1cc(CCC(O)=O)c(NS(=O)(=O)c2ccc(OCC)cc2)c2ccccc12 Show InChI InChI=1S/C29H30N2O8S2/c1-3-38-21-10-14-23(15-11-21)40(34,35)30-27-19-20(9-18-28(32)33)29(26-8-6-5-7-25(26)27)31-41(36,37)24-16-12-22(13-17-24)39-4-2/h5-8,10-17,19,30-31H,3-4,9,18H2,1-2H3,(H,32,33)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	230	n/a	n/a	n/a	n/a	n/a	n/a
Keio University Curated by ChEMBL					Assay Description Inhibition of recombinant GST-His-tagged Keap1-DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli/FAM-labeled Nrf2 (unkno...				Bioorg Med Chem Lett 26: 5956-5959 (2016) Article DOI: 10.1016/j.bmcl.2016.10.083 BindingDB Entry DOI: 10.7270/Q2PC34CB
					More data for this Ligand-Target Pair
Kelch-like ECH-associated protein 1 (Homo sapiens (Human))	BDBM50262958 (CHEMBL4070735) Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1cc2c(C(=O)NNc3ccc(cc3)[N+]([O-])=O)c(C)n(c2c2ccccc12)S(=O)(=O)c1ccc(OC)cc1 Show InChI InChI=1S/C34H29N5O9S2/c1-21-32(34(40)36-35-22-8-10-23(11-9-22)39(41)42)30-20-31(37-49(43,44)26-16-12-24(47-2)13-17-26)28-6-4-5-7-29(28)33(30)38(21)50(45,46)27-18-14-25(48-3)15-19-27/h4-20,35,37H,1-3H3,(H,36,40)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	260	n/a	n/a	n/a	n/a	n/a	n/a
Department of Pharmaceutical Sciences, Faculty of Pharmacy, Keio University, 1-5-30 Shibakoen, Minato-ku, Tokyo, Japan. Curated by ChEMBL					Assay Description Binding affinity to His-tagged Keap1 DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli assessed as reduction in protein ...				Bioorg Med Chem Lett 27: 5006-5009 (2017) Article DOI: 10.1016/j.bmcl.2017.10.008 BindingDB Entry DOI: 10.7270/Q2T15634
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50163033 (CHEMBL3794507) Show SMILES CNC(=O)c1ccc(NC(=O)c2n[nH]c3ccccc23)cc1 Show InChI InChI=1S/C16H14N4O2/c1-17-15(21)10-6-8-11(9-7-10)18-16(22)14-12-4-2-3-5-13(12)19-20-14/h2-9H,1H3,(H,17,21)(H,18,22)(H,19,20)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	281	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Kelch-like ECH-associated protein 1 (Homo sapiens (Human))	BDBM50262956 (CHEMBL4062108) Show SMILES CNNC(=O)c1c(C)n(c2c1cc(NS(=O)(=O)c1ccc(OC)cc1)c1ccccc21)S(=O)(=O)c1ccc(OC)cc1 Show InChI InChI=1S/C29H28N4O7S2/c1-18-27(29(34)31-30-2)25-17-26(32-41(35,36)21-13-9-19(39-3)10-14-21)23-7-5-6-8-24(23)28(25)33(18)42(37,38)22-15-11-20(40-4)12-16-22/h5-17,30,32H,1-4H3,(H,31,34)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
Department of Pharmaceutical Sciences, Faculty of Pharmacy, Keio University, 1-5-30 Shibakoen, Minato-ku, Tokyo, Japan. Curated by ChEMBL					Assay Description Binding affinity to His-tagged Keap1 DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli assessed as reduction in protein ...				Bioorg Med Chem Lett 27: 5006-5009 (2017) Article DOI: 10.1016/j.bmcl.2017.10.008 BindingDB Entry DOI: 10.7270/Q2T15634
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162947 (CHEMBL3794415) Show SMILES Cc1ccc(NC(=O)c2n[nH]c3ccccc23)cc1 Show InChI InChI=1S/C15H13N3O/c1-10-6-8-11(9-7-10)16-15(19)14-12-4-2-3-5-13(12)17-18-14/h2-9H,1H3,(H,16,19)(H,17,18)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	310	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50205337 (CHEMBL3906697) Show SMILES CCOc1ccc(cc1)S(=O)(=O)Nc1cc(CC(O)=O)c(NS(=O)(=O)c2ccc(OCC)cc2)c2ccccc12 Show InChI InChI=1S/C28H28N2O8S2/c1-3-37-20-9-13-22(14-10-20)39(33,34)29-26-17-19(18-27(31)32)28(25-8-6-5-7-24(25)26)30-40(35,36)23-15-11-21(12-16-23)38-4-2/h5-17,29-30H,3-4,18H2,1-2H3,(H,31,32)	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	320	n/a	n/a	n/a	n/a	n/a	n/a
Keio University Curated by ChEMBL					Assay Description Inhibition of recombinant GST-His-tagged Keap1-DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli/FAM-labeled Nrf2 (unkno...				Bioorg Med Chem Lett 26: 5956-5959 (2016) Article DOI: 10.1016/j.bmcl.2016.10.083 BindingDB Entry DOI: 10.7270/Q2PC34CB
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM24634 (N-phenyl-1H-indazole-3-carboxamide | indazole amid...) Show SMILES O=C(Nc1ccccc1)c1n[nH]c2ccccc12 Show InChI InChI=1S/C14H11N3O/c18-14(15-10-6-2-1-3-7-10)13-11-8-4-5-9-12(11)16-17-13/h1-9H,(H,15,18)(H,16,17)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	350	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using fluorescence...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50331283 (CHEMBL1288651 | N-(4-methoxyphenyl)-1H-indazole-3-...) Show SMILES COc1ccc(NC(=O)c2n[nH]c3ccccc23)cc1 Show InChI InChI=1S/C15H13N3O2/c1-20-11-8-6-10(7-9-11)16-15(19)14-12-4-2-3-5-13(12)17-18-14/h2-9H,1H3,(H,16,19)(H,17,18)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	352	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Mitogen-activated protein kinase kinase kinase kinase 4 (Homo sapiens (Human))	BDBM50162967 (CHEMBL3792850) Show SMILES O=C(Nc1ccc(CN2CCN(CC2)c2ccccc2)cc1)c1n[nH]c2ccccc12 Show InChI InChI=1S/C25H25N5O/c31-25(24-22-8-4-5-9-23(22)27-28-24)26-20-12-10-19(11-13-20)18-29-14-16-30(17-15-29)21-6-2-1-3-7-21/h1-13H,14-18H2,(H,26,31)(H,27,28)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	410	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged HGK catalytic domain (1 to 328 residues) expressed in baculovirus expression system using fluorescence labe...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM24634 (N-phenyl-1H-indazole-3-carboxamide | indazole amid...) Show SMILES O=C(Nc1ccccc1)c1n[nH]c2ccccc12 Show InChI InChI=1S/C14H11N3O/c18-14(15-10-6-2-1-3-7-10)13-11-8-4-5-9-12(11)16-17-13/h1-9H,(H,15,18)(H,16,17)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	417	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162948 (CHEMBL3793590) Show SMILES Cc1cccc(NC(=O)c2n[nH]c3ccccc23)c1 Show InChI InChI=1S/C15H13N3O/c1-10-5-4-6-11(9-10)16-15(19)14-12-7-2-3-8-13(12)17-18-14/h2-9H,1H3,(H,16,19)(H,17,18)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	443	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162942 (CHEMBL3792695) Show SMILES COC(=O)c1ccc(NC(=O)c2n[nH]c3ccccc23)cc1 Show InChI InChI=1S/C16H13N3O3/c1-22-16(21)10-6-8-11(9-7-10)17-15(20)14-12-4-2-3-5-13(12)18-19-14/h2-9H,1H3,(H,17,20)(H,18,19)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	552	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50205343 (CHEMBL3953535) Show SMILES CCOc1ccc(cc1)S(=O)(=O)Nc1cc(SCC(=O)OC)c(NS(=O)(=O)c2ccc(OCC)cc2)c2ccccc12 Show InChI InChI=1S/C29H30N2O8S3/c1-4-38-20-10-14-22(15-11-20)41(33,34)30-26-18-27(40-19-28(32)37-3)29(25-9-7-6-8-24(25)26)31-42(35,36)23-16-12-21(13-17-23)39-5-2/h6-18,30-31H,4-5,19H2,1-3H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	720	n/a	n/a	n/a	n/a	n/a	n/a
Keio University Curated by ChEMBL					Assay Description Inhibition of recombinant GST-His-tagged Keap1-DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli/FAM-labeled Nrf2 (unkno...				Bioorg Med Chem Lett 26: 5956-5959 (2016) Article DOI: 10.1016/j.bmcl.2016.10.083 BindingDB Entry DOI: 10.7270/Q2PC34CB
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162945 (CHEMBL3793337) Show SMILES COc1cccc(NC(=O)c2n[nH]c3ccccc23)c1 Show InChI InChI=1S/C15H13N3O2/c1-20-11-6-4-5-10(9-11)16-15(19)14-12-7-2-3-8-13(12)17-18-14/h2-9H,1H3,(H,16,19)(H,17,18)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	786	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Kelch-like ECH-associated protein 1 (Homo sapiens (Human))	BDBM50006931 (CHEMBL2402207) Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)cc2)c2ccccc12 Show InChI InChI=1S/C24H22N2O6S2/c1-31-17-7-11-19(12-8-17)33(27,28)25-23-15-16-24(22-6-4-3-5-21(22)23)26-34(29,30)20-13-9-18(32-2)10-14-20/h3-16,25-26H,1-2H3	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	PDB Article PubMed	n/a	n/a	1.60E+3	n/a	n/a	n/a	n/a	n/a	n/a
Department of Pharmaceutical Sciences, Faculty of Pharmacy, Keio University, 1-5-30 Shibakoen, Minato-ku, Tokyo, Japan. Curated by ChEMBL					Assay Description Binding affinity to His-tagged Keap1 DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli assessed as reduction in protein ...				Bioorg Med Chem Lett 27: 5006-5009 (2017) Article DOI: 10.1016/j.bmcl.2017.10.008 BindingDB Entry DOI: 10.7270/Q2T15634
					More data for this Ligand-Target Pair				3D Structure (crystal)
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50006931 (CHEMBL2402207) Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OC)cc2)c2ccccc12 Show InChI InChI=1S/C24H22N2O6S2/c1-31-17-7-11-19(12-8-17)33(27,28)25-23-15-16-24(22-6-4-3-5-21(22)23)26-34(29,30)20-13-9-18(32-2)10-14-20/h3-16,25-26H,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	1.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Keio University Curated by ChEMBL					Assay Description Inhibition of recombinant GST-His-tagged Keap1-DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli/FAM-labeled Nrf2 (unkno...				Bioorg Med Chem Lett 26: 5956-5959 (2016) Article DOI: 10.1016/j.bmcl.2016.10.083 BindingDB Entry DOI: 10.7270/Q2PC34CB
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162949 (CHEMBL3794143) Show SMILES Cc1ccccc1NC(=O)c1n[nH]c2ccccc12 Show InChI InChI=1S/C15H13N3O/c1-10-6-2-4-8-12(10)16-15(19)14-11-7-3-5-9-13(11)17-18-14/h2-9H,1H3,(H,16,19)(H,17,18)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162969 (CHEMBL3793334) Show SMILES O=C(Nc1ccc(cc1)N1CCN(CC1)c1ccccc1)c1n[nH]c2ccccc12 Show InChI InChI=1S/C24H23N5O/c30-24(23-21-8-4-5-9-22(21)26-27-23)25-18-10-12-20(13-11-18)29-16-14-28(15-17-29)19-6-2-1-3-7-19/h1-13H,14-17H2,(H,25,30)(H,26,27)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162966 (CHEMBL3792787) Show SMILES CN(C(=O)c1n[nH]c2ccccc12)c1ccccc1 Show InChI InChI=1S/C15H13N3O/c1-18(11-7-3-2-4-8-11)15(19)14-12-9-5-6-10-13(12)16-17-14/h2-10H,1H3,(H,16,17)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162943 (CHEMBL3792732) Show SMILES COC(=O)c1cccc(NC(=O)c2n[nH]c3ccccc23)c1 Show InChI InChI=1S/C16H13N3O3/c1-22-16(21)10-5-4-6-11(9-10)17-15(20)14-12-7-2-3-8-13(12)18-19-14/h2-9H,1H3,(H,17,20)(H,18,19)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162944 (CHEMBL3794579) Show SMILES COC(=O)c1ccccc1NC(=O)c1n[nH]c2ccccc12 Show InChI InChI=1S/C16H13N3O3/c1-22-16(21)11-7-3-4-8-12(11)17-15(20)14-10-6-2-5-9-13(10)18-19-14/h2-9H,1H3,(H,17,20)(H,18,19)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162946 (CHEMBL3793040) Show SMILES COc1ccccc1NC(=O)c1n[nH]c2ccccc12 Show InChI InChI=1S/C15H13N3O2/c1-20-13-9-5-4-8-12(13)16-15(19)14-10-6-2-3-7-11(10)17-18-14/h2-9H,1H3,(H,16,19)(H,17,18)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162950 (CHEMBL3792669) Show SMILES O=C(Nc1ccccc1)c1c[nH]c2ccccc12 Show InChI InChI=1S/C15H12N2O/c18-15(17-11-6-2-1-3-7-11)13-10-16-14-9-5-4-8-12(13)14/h1-10,16H,(H,17,18)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Receptor-type tyrosine-protein kinase FLT3 (Homo sapiens (Human))	BDBM50162951 (CHEMBL3792750) Show SMILES Cn1nc(C(=O)Nc2ccccc2)c2ccccc12 Show InChI InChI=1S/C15H13N3O/c1-18-13-10-6-5-9-12(13)14(17-18)15(19)16-11-7-3-2-4-8-11/h2-10H,1H3,(H,16,19)	PDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>2.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
The University of Tokyo Curated by ChEMBL					Assay Description Inhibition of human N-terminal GST-tagged FLT3 cytoplasmic domain (564 to 993 residues) expressed in baculovirus expression system using 5-FAM-peptid...				Bioorg Med Chem Lett 26: 2370-4 (2016) Article DOI: 10.1016/j.bmcl.2016.03.006 BindingDB Entry DOI: 10.7270/Q2TX3H89
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50205339 (CHEMBL3939457) Show SMILES CCOc1ccc(cc1)S(=O)(=O)Nc1ccc(NS(=O)(=O)c2ccc(OCC)cc2)c2ccccc12 Show InChI InChI=1S/C26H26N2O6S2/c1-3-33-19-9-13-21(14-10-19)35(29,30)27-25-17-18-26(24-8-6-5-7-23(24)25)28-36(31,32)22-15-11-20(12-16-22)34-4-2/h5-18,27-28H,3-4H2,1-2H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Keio University Curated by ChEMBL					Assay Description Inhibition of recombinant GST-His-tagged Keap1-DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli/FAM-labeled Nrf2 (unkno...				Bioorg Med Chem Lett 26: 5956-5959 (2016) Article DOI: 10.1016/j.bmcl.2016.10.083 BindingDB Entry DOI: 10.7270/Q2PC34CB
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50205340 (CHEMBL3977467) Show SMILES COc1ccc(cc1)S(=O)(=O)Nc1cc(CC(C)=O)c(NS(=O)(=O)c2ccc(OC)cc2)c2ccccc12 Show InChI InChI=1S/C27H26N2O7S2/c1-18(30)16-19-17-26(28-37(31,32)22-12-8-20(35-2)9-13-22)24-6-4-5-7-25(24)27(19)29-38(33,34)23-14-10-21(36-3)11-15-23/h4-15,17,28-29H,16H2,1-3H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Keio University Curated by ChEMBL					Assay Description Inhibition of recombinant GST-His-tagged Keap1-DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli/FAM-labeled Nrf2 (unkno...				Bioorg Med Chem Lett 26: 5956-5959 (2016) Article DOI: 10.1016/j.bmcl.2016.10.083 BindingDB Entry DOI: 10.7270/Q2PC34CB
					More data for this Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2 (Homo sapiens (Human))	BDBM50205338 (CHEMBL3948237) Show SMILES CCOc1ccc(cc1)S(=O)(=O)Nc1cc(CC(C)=O)c(NS(=O)(=O)c2ccc(OCC)cc2)c2ccccc12 Show InChI InChI=1S/C29H30N2O7S2/c1-4-37-22-10-14-24(15-11-22)39(33,34)30-28-19-21(18-20(3)32)29(27-9-7-6-8-26(27)28)31-40(35,36)25-16-12-23(13-17-25)38-5-2/h6-17,19,30-31H,4-5,18H2,1-3H3	PDB KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	6.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Keio University Curated by ChEMBL					Assay Description Inhibition of recombinant GST-His-tagged Keap1-DC domain (321 to 609 residues) (unknown origin) expressed in Escherichia coli/FAM-labeled Nrf2 (unkno...				Bioorg Med Chem Lett 26: 5956-5959 (2016) Article DOI: 10.1016/j.bmcl.2016.10.083 BindingDB Entry DOI: 10.7270/Q2PC34CB
					More data for this Ligand-Target Pair