Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Superoxide dismutase [Cu-Zn]' and Ligand = 'BDBM50529855'   

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 [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))	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