Compile Data Set for Download or QSAR

Found 14 hits with Last Name = 'medina-carmona' and Initial = 'e'   

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
Superoxide dismutase (Trypanosoma cruzi (strain CL Brener))	BDBM50275725 (CHEMBL4128846) Show SMILES COc1ccc(cc1)C(=O)CCN1CCN(CC1)c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C20H23N3O4/c1-27-19-8-2-16(3-9-19)20(24)10-11-21-12-14-22(15-13-21)17-4-6-18(7-5-17)23(25)26/h2-9H,10-15H2,1H3	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	5.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hospitales Universitarios De Granada/University of Granada Curated by ChEMBL					Assay Description Inhibition of Trypanosoma cruzi MHOM/Pe/2011/Arequipa DTU 5 epimastigotes Fe-SOD by UV-Visible spectrophotometric method				J Med Chem 61: 5643-5663 (2018) Article DOI: 10.1021/acs.jmedchem.8b00468 BindingDB Entry DOI: 10.7270/Q2RF5XHQ
					More data for this Ligand-Target Pair
Superoxide dismutase (Trypanosoma cruzi (strain CL Brener))	BDBM50275711 (CHEMBL4127450) Show SMILES COc1ccc(cc1)C(=O)CCN1CCN(CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C20H23ClN2O2/c1-25-19-8-2-16(3-9-19)20(24)10-11-22-12-14-23(15-13-22)18-6-4-17(21)5-7-18/h2-9H,10-15H2,1H3	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Hospitales Universitarios De Granada/University of Granada Curated by ChEMBL					Assay Description Inhibition of Trypanosoma cruzi MHOM/Pe/2011/Arequipa DTU 5 epimastigotes Fe-SOD by UV-Visible spectrophotometric method				J Med Chem 61: 5643-5663 (2018) Article DOI: 10.1021/acs.jmedchem.8b00468 BindingDB Entry DOI: 10.7270/Q2RF5XHQ
					More data for this Ligand-Target Pair
Superoxide dismutase (Trypanosoma cruzi (strain CL Brener))	BDBM50275760 (CHEMBL4129006) Show SMILES COc1ccc(cc1)C(=O)CCN1CCN(CC1)c1ccc(F)cc1 Show InChI InChI=1S/C20H23FN2O2/c1-25-19-8-2-16(3-9-19)20(24)10-11-22-12-14-23(15-13-22)18-6-4-17(21)5-7-18/h2-9H,10-15H2,1H3	PDB UniProtKB/TrEMBL GoogleScholar AffyNet	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
Hospitales Universitarios De Granada/University of Granada Curated by ChEMBL					Assay Description Inhibition of Trypanosoma cruzi MHOM/Pe/2011/Arequipa DTU 5 epimastigotes Fe-SOD by UV-Visible spectrophotometric method				J Med Chem 61: 5643-5663 (2018) Article DOI: 10.1021/acs.jmedchem.8b00468 BindingDB Entry DOI: 10.7270/Q2RF5XHQ
					More data for this Ligand-Target Pair
Superoxide dismutase [Cu-Zn] (Homo sapiens (Human))	BDBM50275725 (CHEMBL4128846) Show SMILES COc1ccc(cc1)C(=O)CCN1CCN(CC1)c1ccc(cc1)[N+]([O-])=O Show InChI InChI=1S/C20H23N3O4/c1-27-19-8-2-16(3-9-19)20(24)10-11-21-12-14-22(15-13-21)17-4-6-18(7-5-17)23(25)26/h2-9H,10-15H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Hospitales Universitarios De Granada/University of Granada Curated by ChEMBL					Assay Description Inhibition of human erythrocyte CuZn-SOD by UV-Visible spectrophotometric method				J Med Chem 61: 5643-5663 (2018) Article DOI: 10.1021/acs.jmedchem.8b00468 BindingDB Entry DOI: 10.7270/Q2RF5XHQ
					More data for this Ligand-Target Pair
Superoxide dismutase [Cu-Zn] (Homo sapiens (Human))	BDBM50275711 (CHEMBL4127450) Show SMILES COc1ccc(cc1)C(=O)CCN1CCN(CC1)c1ccc(Cl)cc1 Show InChI InChI=1S/C20H23ClN2O2/c1-25-19-8-2-16(3-9-19)20(24)10-11-22-12-14-23(15-13-22)18-6-4-17(21)5-7-18/h2-9H,10-15H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Hospitales Universitarios De Granada/University of Granada Curated by ChEMBL					Assay Description Inhibition of human erythrocyte CuZn-SOD by UV-Visible spectrophotometric method				J Med Chem 61: 5643-5663 (2018) Article DOI: 10.1021/acs.jmedchem.8b00468 BindingDB Entry DOI: 10.7270/Q2RF5XHQ
					More data for this Ligand-Target Pair
Superoxide dismutase [Cu-Zn] (Homo sapiens (Human))	BDBM50529854 (CHEMBL4451604) Show SMILES Cl.Cl.Cl.NCCN(CCN)CCNCc1ccc-2c(Cc3ccccc-23)c1 Show InChI InChI=1S/C20H28N4/c21-7-10-24(11-8-22)12-9-23-15-16-5-6-20-18(13-16)14-17-3-1-2-4-19(17)20/h1-6,13,23H,7-12,14-15,21-22H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Hospitales Universitarios de Granada/University of Granada Curated by ChEMBL					Assay Description Inhibition of human erythrocyte CuZn-SOD by UV-Visible spectrophotometric method				Eur J Med Chem 164: 27-46 (2019) Article DOI: 10.1016/j.ejmech.2018.12.034 BindingDB Entry DOI: 10.7270/Q2DF6VPD
					More data for this Ligand-Target Pair
Superoxide dismutase [Cu-Zn] (Homo sapiens (Human))	BDBM50530374 (CHEMBL4447402) Show SMILES CCCCCCNc1c(N(C)CCCN(C)C)c(=O)c1=O Show InChI InChI=1S/C16H29N3O2/c1-5-6-7-8-10-17-13-14(16(21)15(13)20)19(4)12-9-11-18(2)3/h17H,5-12H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Hospitales Universitarios de Granada/University of Granada Curated by ChEMBL					Assay Description Inhibition of human erythrocyte CuZn-SOD by UV-Visible spectrophotometric method				Bioorg Med Chem 27: 865-879 (2019) Article DOI: 10.1016/j.bmc.2019.01.033 BindingDB Entry DOI: 10.7270/Q24T6NT1
					More data for this Ligand-Target Pair
Superoxide dismutase [Cu-Zn] (Homo sapiens (Human))	BDBM50529855 (CHEMBL4449798) Show SMILES Cl.Cl.Cl.Cl.Cl.Cl.C(CN(CCNCc1ccc2ccccc2n1)CCNCc1ccc2ccccc2n1)NCc1ccc2ccccc2n1 Show InChI InChI=1S/C36H39N7/c1-4-10-34-28(7-1)13-16-31(40-34)25-37-19-22-43(23-20-38-26-32-17-14-29-8-2-5-11-35(29)41-32)24-21-39-27-33-18-15-30-9-3-6-12-36(30)42-33/h1-18,37-39H,19-27H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Hospitales Universitarios de Granada/University of Granada Curated by ChEMBL					Assay Description Inhibition of human erythrocyte CuZn-SOD by UV-Visible spectrophotometric method				Eur J Med Chem 164: 27-46 (2019) Article DOI: 10.1016/j.ejmech.2018.12.034 BindingDB Entry DOI: 10.7270/Q2DF6VPD
					More data for this Ligand-Target Pair
Superoxide dismutase [Cu-Zn] (Homo sapiens (Human))	BDBM50529854 (CHEMBL4451604) Show SMILES Cl.Cl.Cl.NCCN(CCN)CCNCc1ccc-2c(Cc3ccccc-23)c1 Show InChI InChI=1S/C20H28N4/c21-7-10-24(11-8-22)12-9-23-15-16-5-6-20-18(13-16)14-17-3-1-2-4-19(17)20/h1-6,13,23H,7-12,14-15,21-22H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Hospitales Universitarios de Granada/University of Granada Curated by ChEMBL					Assay Description Inhibition of human erythrocyte CuZn-SOD by UV-Visible spectrophotometric method				Eur J Med Chem 164: 27-46 (2019) Article DOI: 10.1016/j.ejmech.2018.12.034 BindingDB Entry DOI: 10.7270/Q2DF6VPD
					More data for this Ligand-Target Pair
Superoxide dismutase [Cu-Zn] (Homo sapiens (Human))	BDBM50529855 (CHEMBL4449798) Show SMILES Cl.Cl.Cl.Cl.Cl.Cl.C(CN(CCNCc1ccc2ccccc2n1)CCNCc1ccc2ccccc2n1)NCc1ccc2ccccc2n1 Show InChI InChI=1S/C36H39N7/c1-4-10-34-28(7-1)13-16-31(40-34)25-37-19-22-43(23-20-38-26-32-17-14-29-8-2-5-11-35(29)41-32)24-21-39-27-33-18-15-30-9-3-6-12-36(30)42-33/h1-18,37-39H,19-27H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Hospitales Universitarios de Granada/University of Granada Curated by ChEMBL					Assay Description Inhibition of human erythrocyte CuZn-SOD by UV-Visible spectrophotometric method				Eur J Med Chem 164: 27-46 (2019) Article DOI: 10.1016/j.ejmech.2018.12.034 BindingDB Entry DOI: 10.7270/Q2DF6VPD
					More data for this Ligand-Target Pair
Superoxide dismutase [Cu-Zn] (Homo sapiens (Human))	BDBM50530374 (CHEMBL4447402) Show SMILES CCCCCCNc1c(N(C)CCCN(C)C)c(=O)c1=O Show InChI InChI=1S/C16H29N3O2/c1-5-6-7-8-10-17-13-14(16(21)15(13)20)19(4)12-9-11-18(2)3/h17H,5-12H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Hospitales Universitarios de Granada/University of Granada Curated by ChEMBL					Assay Description Inhibition of human erythrocyte CuZn-SOD by UV-Visible spectrophotometric method				Bioorg Med Chem 27: 865-879 (2019) Article DOI: 10.1016/j.bmc.2019.01.033 BindingDB Entry DOI: 10.7270/Q24T6NT1
					More data for this Ligand-Target Pair
Superoxide dismutase [Cu-Zn] (Homo sapiens (Human))	BDBM50530375 (CHEMBL4450115) Show SMILES CCCCCCCCCCCCCCCCNc1c(N(C)CCCN(C)C)c(=O)c1=O Show InChI InChI=1S/C26H49N3O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-27-23-24(26(31)25(23)30)29(4)22-19-21-28(2)3/h27H,5-22H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Hospitales Universitarios de Granada/University of Granada Curated by ChEMBL					Assay Description Inhibition of human erythrocyte CuZn-SOD by UV-Visible spectrophotometric method				Bioorg Med Chem 27: 865-879 (2019) Article DOI: 10.1016/j.bmc.2019.01.033 BindingDB Entry DOI: 10.7270/Q24T6NT1
					More data for this Ligand-Target Pair
Superoxide dismutase [Cu-Zn] (Homo sapiens (Human))	BDBM50530375 (CHEMBL4450115) Show SMILES CCCCCCCCCCCCCCCCNc1c(N(C)CCCN(C)C)c(=O)c1=O Show InChI InChI=1S/C26H49N3O2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-20-27-23-24(26(31)25(23)30)29(4)22-19-21-28(2)3/h27H,5-22H2,1-4H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Hospitales Universitarios de Granada/University of Granada Curated by ChEMBL					Assay Description Inhibition of human erythrocyte CuZn-SOD by UV-Visible spectrophotometric method				Bioorg Med Chem 27: 865-879 (2019) Article DOI: 10.1016/j.bmc.2019.01.033 BindingDB Entry DOI: 10.7270/Q24T6NT1
					More data for this Ligand-Target Pair
Superoxide dismutase [Cu-Zn] (Homo sapiens (Human))	BDBM50275760 (CHEMBL4129006) Show SMILES COc1ccc(cc1)C(=O)CCN1CCN(CC1)c1ccc(F)cc1 Show InChI InChI=1S/C20H23FN2O2/c1-25-19-8-2-16(3-9-19)20(24)10-11-22-12-14-23(15-13-22)18-6-4-17(21)5-7-18/h2-9H,10-15H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.46E+5	n/a	n/a	n/a	n/a	n/a	n/a
Hospitales Universitarios De Granada/University of Granada Curated by ChEMBL					Assay Description Inhibition of human erythrocyte CuZn-SOD by UV-Visible spectrophotometric method				J Med Chem 61: 5643-5663 (2018) Article DOI: 10.1021/acs.jmedchem.8b00468 BindingDB Entry DOI: 10.7270/Q2RF5XHQ
					More data for this Ligand-Target Pair