Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Urease subunit beta' and Ligand = 'BDBM50476589'   

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
Urease subunit beta (Helicobacter pylori (strain ATCC 700392 / 26695) (...)	BDBM50476589 (4-(P-Hydroxyphenethyl)Pyrogallol | CHEMBL243822) Show SMILES Oc1ccc(CCc2ccc(O)c(O)c2O)cc1 Show InChI InChI=1S/C14H14O4/c15-11-6-2-9(3-7-11)1-4-10-5-8-12(16)14(18)13(10)17/h2-3,5-8,15-18H,1,4H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of Helicobacter pylori ATCC 43504 urease after 3 hrs pre-incubation				Bioorg Med Chem 15: 3703-10 (2007) Article DOI: 10.1016/j.bmc.2007.03.045 BindingDB Entry DOI: 10.7270/Q2P55R84
					More data for this Ligand-Target Pair
Urease subunit beta (Helicobacter pylori (strain ATCC 700392 / 26695) (...)	BDBM50476589 (4-(P-Hydroxyphenethyl)Pyrogallol | CHEMBL243822) Show SMILES Oc1ccc(CCc2ccc(O)c(O)c2O)cc1 Show InChI InChI=1S/C14H14O4/c15-11-6-2-9(3-7-11)1-4-10-5-8-12(16)14(18)13(10)17/h2-3,5-8,15-18H,1,4H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.20E+4	n/a	n/a	n/a	n/a	n/a	n/a
Jishou University Curated by ChEMBL					Assay Description Inhibition of cell free Helicobacter pylori ATCC 43504 urease assessed as reduction in ammonia production by indophenol based Berthelot color reactio...				Eur J Med Chem 45: 5064-70 (2010) Article DOI: 10.1016/j.ejmech.2010.08.015 BindingDB Entry DOI: 10.7270/Q2R78J2D
					More data for this Ligand-Target Pair
Urease subunit beta (Helicobacter pylori (strain ATCC 700392 / 26695) (...)	BDBM50476589 (4-(P-Hydroxyphenethyl)Pyrogallol | CHEMBL243822) Show SMILES Oc1ccc(CCc2ccc(O)c(O)c2O)cc1 Show InChI InChI=1S/C14H14O4/c15-11-6-2-9(3-7-11)1-4-10-5-8-12(16)14(18)13(10)17/h2-3,5-8,15-18H,1,4H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.30E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of Helicobacter pylori ATCC 43504 urease in presence of 0.4 mM dithiothreitol after 3 hrs pre-incubation				Bioorg Med Chem 15: 3703-10 (2007) Article DOI: 10.1016/j.bmc.2007.03.045 BindingDB Entry DOI: 10.7270/Q2P55R84
					More data for this Ligand-Target Pair
Urease subunit beta (Helicobacter pylori (strain ATCC 700392 / 26695) (...)	BDBM50476589 (4-(P-Hydroxyphenethyl)Pyrogallol | CHEMBL243822) Show SMILES Oc1ccc(CCc2ccc(O)c(O)c2O)cc1 Show InChI InChI=1S/C14H14O4/c15-11-6-2-9(3-7-11)1-4-10-5-8-12(16)14(18)13(10)17/h2-3,5-8,15-18H,1,4H2	PDB UniProtKB/SwissProt GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Nanjing University Curated by ChEMBL					Assay Description Inhibition of Helicobacter pylori ATCC 43504 urease in presence of 0.4 mM 2-mercaptoethanol after 3 hrs pre-incubation				Bioorg Med Chem 15: 3703-10 (2007) Article DOI: 10.1016/j.bmc.2007.03.045 BindingDB Entry DOI: 10.7270/Q2P55R84
					More data for this Ligand-Target Pair