Affinity Data by PubMed id=17197182

PubMed code 17197182

Found 26 hits of Enzyme Inhibition Constant Data
Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	k_off s^-1	k_on M^-1s^-1	pH	Temp °C
Trypanothione reductase (Trypanosoma brucei brucei)	BDBM50201774 (3-(dimethylamino)-1-(3-nitrophenyl)propan-1-one hy...) Show SMILES CN(C)CCC(=O)c1cccc(c1)[N+]([O-])=O Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	340	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of TR by DTNB-coupled assay				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Trypanothione reductase (Trypanosoma brucei brucei)	BDBM50201776 (3-(2,3-dimethylphenylamino)-1-(3-nitrophenyl)propa...) Show SMILES Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of TR by DTNB-coupled assay				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Trypanothione reductase (Trypanosoma brucei brucei)	BDBM34731 (1-(3-nitrophenyl)-3-phenylazanyl-propan-1-one \| 3-...) Show SMILES [O-][N+](=O)c1cccc(c1)C(=O)CCNc1ccccc1 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of TR by DTNB-coupled assay				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Trypanothione reductase (Trypanosoma brucei brucei)	BDBM50201777 (2,6-di-tert-butyl-4-((2-hydroxyethylamino)methyl)p...) Show SMILES CC(C)(C)c1cc(CNCCO)cc(c1O)C(C)(C)C Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD 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
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of TR by DTNB-coupled assay				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Trypanothione reductase (Trypanosoma brucei brucei)	BDBM50201781 (CHEMBL233339 \| butyl 4-(3-(3-nitrophenyl)-3-oxopro...) Show SMILES Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.40E+3	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of TR by DTNB-coupled assay				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Trypanothione reductase (Trypanosoma brucei brucei)	BDBM50201778 (3-(dimethylamino)-1-(4-(methylsulfonyl)phenyl)prop...) Show SMILES CN(C)CCC(=O)c1ccc(cc1)S(C)(=O)=O Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of TR by DTNB-coupled assay				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Trypanothione reductase (Trypanosoma brucei brucei)	BDBM50201782 (1-(3,4-dichlorophenyl)-3-(dimethylamino)propan-1-o...) Show SMILES CN(C)CCC(=O)c1ccc(Cl)c(Cl)c1 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of TR by DTNB-coupled assay				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Trypanothione reductase (Trypanosoma brucei brucei)	BDBM50201775 (3-(3-fluorophenylamino)-1-(3-nitrophenyl)propan-1-...) Show SMILES Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.30E+3	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of TR by DTNB-coupled assay				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Trypanothione reductase (Trypanosoma brucei brucei)	BDBM50201784 (1-(4-(methylsulfonyl)phenyl)-3-(piperidin-1-yl)pro...) Show SMILES CS(=O)(=O)c1ccc(cc1)C(=O)CCN1CCCCC1 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of TR by DTNB-coupled assay				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Trypanothione reductase (Trypanosoma brucei brucei)	BDBM50064429 (4-((dimethylamino)methyl)-2,6-diisopropylphenol \| ...) Show SMILES CC(C)c1cc(CN(C)C)cc(C(C)C)c1O Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	1.18E+4	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of TR by DTNB-coupled assay				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Glutathione reductase, mitochondrial (Homo sapiens (Human))	BDBM50201774 (3-(dimethylamino)-1-(3-nitrophenyl)propan-1-one hy...) Show SMILES CN(C)CCC(=O)c1cccc(c1)[N+]([O-])=O Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.03E+4	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of human GR				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Glutathione reductase, mitochondrial (Homo sapiens (Human))	BDBM50201778 (3-(dimethylamino)-1-(4-(methylsulfonyl)phenyl)prop...) Show SMILES CN(C)CCC(=O)c1ccc(cc1)S(C)(=O)=O Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.04E+4	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of human GR				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Glutathione reductase, mitochondrial (Homo sapiens (Human))	BDBM50201777 (2,6-di-tert-butyl-4-((2-hydroxyethylamino)methyl)p...) Show SMILES CC(C)(C)c1cc(CNCCO)cc(c1O)C(C)(C)C Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.49E+4	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of human GR				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Trypanothione reductase (Trypanosoma brucei brucei)	BDBM50201783 (4-(azepan-1-ylmethyl)-2,6-di-tert-butylphenol \| CH...) Show SMILES CC(C)(C)c1cc(CN2CCCCCC2)cc(c1O)C(C)(C)C Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.88E+4	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of TR by DTNB-coupled assay				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Glutathione reductase, mitochondrial (Homo sapiens (Human))	BDBM34731 (1-(3-nitrophenyl)-3-phenylazanyl-propan-1-one \| 3-...) Show SMILES [O-][N+](=O)c1cccc(c1)C(=O)CCNc1ccccc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.80E+4	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of human GR				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Glutathione reductase, mitochondrial (Homo sapiens (Human))	BDBM50201782 (1-(3,4-dichlorophenyl)-3-(dimethylamino)propan-1-o...) Show SMILES CN(C)CCC(=O)c1ccc(Cl)c(Cl)c1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.48E+4	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of human GR				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Glutathione reductase, mitochondrial (Homo sapiens (Human))	BDBM50064429 (4-((dimethylamino)methyl)-2,6-diisopropylphenol \| ...) Show SMILES CC(C)c1cc(CN(C)C)cc(C(C)C)c1O Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	7.93E+4	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of human GR				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Glutathione reductase, mitochondrial (Homo sapiens (Human))	BDBM50201776 (3-(2,3-dimethylphenylamino)-1-(3-nitrophenyl)propa...) Show SMILES Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.63E+4	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of human GR				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Glutathione reductase, mitochondrial (Homo sapiens (Human))	BDBM50201784 (1-(4-(methylsulfonyl)phenyl)-3-(piperidin-1-yl)pro...) Show SMILES CS(=O)(=O)c1ccc(cc1)C(=O)CCN1CCCCC1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.05E+5	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of human GR				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Trypanothione reductase (Trypanosoma brucei brucei)	BDBM50201779 (1-(3,4-dichlorophenyl)-3-(4-ethylphenylamino)propa...) Show SMILES CCc1ccc(NCCC(=O)c2ccc(Cl)c(Cl)c2)cc1 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.07E+5	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of TR by DTNB-coupled assay				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Glutathione reductase, mitochondrial (Homo sapiens (Human))	BDBM50201781 (CHEMBL233339 \| butyl 4-(3-(3-nitrophenyl)-3-oxopro...) Show SMILES Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.35E+5	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of human GR				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Trypanothione reductase (Trypanosoma brucei brucei)	BDBM50201780 (1-(4-chlorophenyl)-3-morpholinopropan-1-one \| CHEM...) Show SMILES Clc1ccc(cc1)C(=O)CCN1CCOCC1 Show InChI	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	1.48E+5	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of TR by DTNB-coupled assay				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Glutathione reductase, mitochondrial (Homo sapiens (Human))	BDBM50201783 (4-(azepan-1-ylmethyl)-2,6-di-tert-butylphenol \| CH...) Show SMILES CC(C)(C)c1cc(CN2CCCCCC2)cc(c1O)C(C)(C)C Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.55E+5	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of human GR				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Glutathione reductase, mitochondrial (Homo sapiens (Human))	BDBM50201779 (1-(3,4-dichlorophenyl)-3-(4-ethylphenylamino)propa...) Show SMILES CCc1ccc(NCCC(=O)c2ccc(Cl)c(Cl)c2)cc1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.57E+5	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of human GR				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Glutathione reductase, mitochondrial (Homo sapiens (Human))	BDBM50201775 (3-(3-fluorophenylamino)-1-(3-nitrophenyl)propan-1-...) Show SMILES Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.73E+5	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of human GR				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair
Glutathione reductase, mitochondrial (Homo sapiens (Human))	BDBM50201780 (1-(4-chlorophenyl)-3-morpholinopropan-1-one \| CHEM...) Show SMILES Clc1ccc(cc1)C(=O)CCN1CCOCC1 Show InChI	PDB UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	>2.12E+5	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of human GR				Bioorg Med Chem Lett 17: 1280-3 (2007) Article DOI: 10.1016/j.bmcl.2006.12.016 BindingDB Entry DOI: 10.7270/Q2CF9QXQ
Harvard Medical School Curated by ChEMBL					More data for this Ligand-Target Pair

* indicates data uncertainty>20%