Compile Data Set for Download or QSAR

Found 40 hits for UniProtKB: P41020   

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 alpha/beta/gamma (Bacillus pasteurii)	BDBM24969 ([(2-{[(benzyloxy)carbonyl]amino}acetamido)methyl](...) Show SMILES CP(O)(=S)CNC(=O)CNC(=O)OCc1ccccc1 Show InChI InChI=1S/C12H17N2O4PS/c1-19(17,20)9-14-11(15)7-13-12(16)18-8-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,13,16)(H,14,15)(H,17,20)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	170	-39.3	1.80E+3	n/a	n/a	n/a	n/a	7.0	30
Wroclaw University of Technology					Assay Description Progress curves were obtained by initiation of urease reaction with addition of purified enzyme into assay mixtures containing increasing concentrati...				J Med Chem 51: 5736-44 (2008) Article DOI: 10.1021/jm800570q BindingDB Entry DOI: 10.7270/Q2PR7T91
					More data for this Ligand-Target Pair
Urease subunit alpha/beta/gamma (Bacillus pasteurii)	BDBM24971 (({[(benzyloxy)carbonyl]amino}methyl)(methyl)sulfan...) Show SMILES CP(O)(=S)CNC(=O)OCc1ccccc1 Show InChI InChI=1S/C10H14NO3PS/c1-15(13,16)8-11-10(12)14-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,11,12)(H,13,16)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.75E+4	-27.6	1.12E+5	n/a	n/a	n/a	n/a	7.0	30
Wroclaw University of Technology					Assay Description Progress curves were obtained by initiation of urease reaction with addition of purified enzyme into assay mixtures containing increasing concentrati...				J Med Chem 51: 5736-44 (2008) Article DOI: 10.1021/jm800570q BindingDB Entry DOI: 10.7270/Q2PR7T91
					More data for this Ligand-Target Pair
Urease subunit alpha/beta/gamma (Bacillus pasteurii)	BDBM24967 (methyl[(methylamino)methyl]phosphinic acid | organ...) Show SMILES CN=CP(C)(O)O |w:1.0| Show InChI InChI=1S/C3H10NO2P/c1-4-3-7(2,5)6/h3,5-7H,1-2H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.80E+4	-27.5	6.00E+4	n/a	n/a	n/a	n/a	7.0	30
Wroclaw University of Technology					Assay Description Progress curves were obtained by initiation of urease reaction with addition of purified enzyme into assay mixtures containing increasing concentrati...				J Med Chem 51: 5736-44 (2008) Article DOI: 10.1021/jm800570q BindingDB Entry DOI: 10.7270/Q2PR7T91
					More data for this Ligand-Target Pair
Urease subunit alpha/beta/gamma (Bacillus pasteurii)	BDBM24962 ([(2-aminoacetamido)methyl](methyl)phosphinic acid ...) Show SMILES CP(O)(=O)CNC(=O)CN Show InChI InChI=1S/C4H11N2O3P/c1-10(8,9)3-6-4(7)2-5/h2-3,5H2,1H3,(H,6,7)(H,8,9)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.10E+4	-27.1	6.00E+4	n/a	n/a	n/a	n/a	7.0	30
Wroclaw University of Technology					Assay Description Progress curves were obtained by initiation of urease reaction with addition of purified enzyme into assay mixtures containing increasing concentrati...				J Med Chem 51: 5736-44 (2008) Article DOI: 10.1021/jm800570q BindingDB Entry DOI: 10.7270/Q2PR7T91
					More data for this Ligand-Target Pair
Urease subunit alpha/beta/gamma (Bacillus pasteurii)	BDBM24965 (organophosphorus derivative, 6 | {[(2S)-2-amino-3-...) Show SMILES CP(O)(=O)CNC(=O)[C@@H](N)COCc1ccccc1 |r| Show InChI InChI=1S/C12H19N2O4P/c1-19(16,17)9-14-12(15)11(13)8-18-7-10-5-3-2-4-6-10/h2-6,11H,7-9,13H2,1H3,(H,14,15)(H,16,17)/t11-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.50E+4	-26.7	8.00E+4	n/a	n/a	n/a	n/a	7.0	30
Wroclaw University of Technology					Assay Description Progress curves were obtained by initiation of urease reaction with addition of purified enzyme into assay mixtures containing increasing concentrati...				J Med Chem 51: 5736-44 (2008) Article DOI: 10.1021/jm800570q BindingDB Entry DOI: 10.7270/Q2PR7T91
					More data for this Ligand-Target Pair
Urease subunit alpha/beta/gamma (Bacillus pasteurii)	BDBM24966 (organophosphorus derivative, 7 | {[(2S)-2-amino-3-...) Show SMILES CP(O)(=O)CNC(=O)[C@@H](N)CO |r| Show InChI InChI=1S/C5H13N2O4P/c1-12(10,11)3-7-5(9)4(6)2-8/h4,8H,2-3,6H2,1H3,(H,7,9)(H,10,11)/t4-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	3.70E+4	-25.7	1.50E+5	n/a	n/a	n/a	n/a	7.0	30
Wroclaw University of Technology					Assay Description Progress curves were obtained by initiation of urease reaction with addition of purified enzyme into assay mixtures containing increasing concentrati...				J Med Chem 51: 5736-44 (2008) Article DOI: 10.1021/jm800570q BindingDB Entry DOI: 10.7270/Q2PR7T91
					More data for this Ligand-Target Pair
Urease subunit alpha/beta/gamma (Bacillus pasteurii)	BDBM24968 (({[(benzyloxy)carbonyl]amino}methyl)(methyl)phosph...) Show SMILES CP(O)(=O)CNC(=O)OCc1ccccc1 Show InChI InChI=1S/C10H14NO4P/c1-16(13,14)8-11-10(12)15-7-9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H,11,12)(H,13,14)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	4.30E+4	-25.3	1.23E+5	n/a	n/a	n/a	n/a	7.0	30
Wroclaw University of Technology					Assay Description Progress curves were obtained by initiation of urease reaction with addition of purified enzyme into assay mixtures containing increasing concentrati...				J Med Chem 51: 5736-44 (2008) Article DOI: 10.1021/jm800570q BindingDB Entry DOI: 10.7270/Q2PR7T91
					More data for this Ligand-Target Pair
Urease subunit alpha/beta/gamma (Bacillus pasteurii)	BDBM24963 (organophosphorus derivative, 4 | {[(2S)-2-amino-3-...) Show SMILES CC(C)[C@H](N)C(=O)NCP(C)(O)=O |r| Show InChI InChI=1S/C7H17N2O3P/c1-5(2)6(8)7(10)9-4-13(3,11)12/h5-6H,4,8H2,1-3H3,(H,9,10)(H,11,12)/t6-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.20E+5	-22.8	4.85E+5	n/a	n/a	n/a	n/a	7.0	30
Wroclaw University of Technology					Assay Description Progress curves were obtained by initiation of urease reaction with addition of purified enzyme into assay mixtures containing increasing concentrati...				J Med Chem 51: 5736-44 (2008) Article DOI: 10.1021/jm800570q BindingDB Entry DOI: 10.7270/Q2PR7T91
					More data for this Ligand-Target Pair
Urease subunit alpha/beta/gamma (Bacillus pasteurii)	BDBM24970 ([(2-{[(benzyloxy)carbonyl]amino}acetamido)methyl](...) Show SMILES CP(O)(=O)CNC(=O)CNC(=O)OCc1ccccc1 Show InChI InChI=1S/C12H17N2O5P/c1-20(17,18)9-14-11(15)7-13-12(16)19-8-10-5-3-2-4-6-10/h2-6H,7-9H2,1H3,(H,13,16)(H,14,15)(H,17,18)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	1.35E+5	-22.5	4.50E+5	n/a	n/a	n/a	n/a	7.0	30
Wroclaw University of Technology					Assay Description Progress curves were obtained by initiation of urease reaction with addition of purified enzyme into assay mixtures containing increasing concentrati...				J Med Chem 51: 5736-44 (2008) Article DOI: 10.1021/jm800570q BindingDB Entry DOI: 10.7270/Q2PR7T91
					More data for this Ligand-Target Pair
Urease subunit alpha/beta/gamma (Bacillus pasteurii)	BDBM24964 (organophosphorus derivative, 5 | {[(2S)-2-amino-3-...) Show SMILES CP(O)(=O)CNC(=O)[C@@H](N)Cc1ccccc1 |r| Show InChI InChI=1S/C11H17N2O3P/c1-17(15,16)8-13-11(14)10(12)7-9-5-3-2-4-6-9/h2-6,10H,7-8,12H2,1H3,(H,13,14)(H,15,16)/t10-/m0/s1	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	2.15E+5	-21.3	6.00E+5	n/a	n/a	n/a	n/a	7.0	30
Wroclaw University of Technology					Assay Description Progress curves were obtained by initiation of urease reaction with addition of purified enzyme into assay mixtures containing increasing concentrati...				J Med Chem 51: 5736-44 (2008) Article DOI: 10.1021/jm800570q BindingDB Entry DOI: 10.7270/Q2PR7T91
					More data for this Ligand-Target Pair
Urease subunit alpha/beta/gamma (Bacillus pasteurii)	BDBM24960 ((aminomethyl)(methyl)phosphinic acid | organophosp...) Show SMILES CP(O)(O)C=N Show InChI InChI=1S/C2H8NO2P/c1-6(4,5)2-3/h2-6H,1H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Patents	Article PubMed	3.40E+5	-20.1	1.10E+6	n/a	n/a	n/a	n/a	7.0	30
Wroclaw University of Technology					Assay Description Progress curves were obtained by initiation of urease reaction with addition of purified enzyme into assay mixtures containing increasing concentrati...				J Med Chem 51: 5736-44 (2008) Article DOI: 10.1021/jm800570q BindingDB Entry DOI: 10.7270/Q2PR7T91
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173607 ((Z)-2-((Z)-(Napthalen-1-ylmethylene)hydrazono)thia...) Show SMILES COc1cc(\C=N/N=C2\NC(=O)CS2)c(OC)cc1Br Show InChI InChI=1S/C12H12BrN3O3S/c1-18-9-4-8(13)10(19-2)3-7(9)5-14-16-12-15-11(17)6-20-12/h3-5H,6H2,1-2H3,(H,15,16,17)/b14-5-	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.73E+3	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173602 ((Z)-2-((Z)-(1-(2-Bromo-4-nitrophenyl)ethylidene)hy...) Show SMILES C\C(=N\N=C1/NC(=O)CS1)c1ccc(cc1Br)[N+]([O-])=O Show InChI InChI=1S/C11H9BrN4O3S/c1-6(14-15-11-13-10(17)5-20-11)8-3-2-7(16(18)19)4-9(8)12/h2-4H,5H2,1H3,(H,13,15,17)/b14-6-	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.31E+3	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173604 ((Z)-2-((Z)-(4-Ethoxy-3-methoxybenzoylidine)hydrazo...) Show SMILES CCOc1ccc(\C=N/N=C2\NC(=O)CS2)cc1OC Show InChI InChI=1S/C13H15N3O3S/c1-3-19-10-5-4-9(6-11(10)18-2)7-14-16-13-15-12(17)8-20-13/h4-7H,3,8H2,1-2H3,(H,15,16,17)/b14-7-	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.75E+3	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173597 ((E)-2-((E)-(4-(Benzyloxy)-2-methoxybenzylidene)hyd...) Show SMILES CN(C)c1ccc(\C=N\N=C2/NC(=O)CS2)cc1 Show InChI InChI=1S/C18H17N3O3S/c1-23-16-9-15(24-11-13-5-3-2-4-6-13)8-7-14(16)10-19-21-18-20-17(22)12-25-18/h2-10H,11-12H2,1H3,(H,20,21,22)/b19-10+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	7.30E+3	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173595 ((E)-2((E)-(3-nitrobenzylidene)hydrazono)thiazolidi...) Show SMILES [O-][N+](=O)c1cccc(\C=N\N=C2/NC(=O)CS2)c1 Show InChI InChI=1S/C10H8N4O3S/c15-9-6-18-10(12-9)13-11-5-7-2-1-3-8(4-7)14(16)17/h1-5H,6H2,(H,12,13,15)/b11-5+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.43E+3	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM60584 ((Z)-2-((Z)-(Napthalen-1-ylmethylene)hydrazono)thia...) Show SMILES Oc1ccc(\C=N/N=C2\NC(=O)CS2)c(O)c1 Show InChI InChI=1S/C10H9N3O3S/c14-7-2-1-6(8(15)3-7)4-11-13-10-12-9(16)5-17-10/h1-4,14-15H,5H2,(H,12,13,16)/b11-4-	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	8.81E+3	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173590 ((E)-2-((E)-(3-Chloro-4-hydroxybenzylideno)thiazoli...) Show SMILES Oc1ccc(\C=N/N=C2\NC(=O)CS2)cc1Cl Show InChI InChI=1S/C10H8ClN3O2S/c11-7-3-6(1-2-8(7)15)4-12-14-10-13-9(16)5-17-10/h1-4,15H,5H2,(H,13,14,16)/b12-4-	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.34E+3	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM181105 (3-(3,4,5-Trimethoxybenzoyl)-(4-hydroxycoumarin) (9...) Show SMILES COc1cc(cc(OC)c1OC)C(=O)c1c(O)c2ccccc2oc1=O Show InChI InChI=1S/C19H16O7/c1-23-13-8-10(9-14(24-2)18(13)25-3)16(20)15-17(21)11-6-4-5-7-12(11)26-19(15)22/h4-9,21H,1-3H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.13E+4	n/a	n/a	n/a	n/a	n/a	30
COMSATS Institute of Information Technology					Assay Description Reaction mixtures comprising one unit of urease enzyme (B. pasteurii) solution and 55 µL of buffers containing 100 mMol urea were incubated with 5 µL...				Bioorg Chem 66: 111-6 (2016) Article DOI: 10.1016/j.bioorg.2016.04.005 BindingDB Entry DOI: 10.7270/Q2QZ28RQ
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM181103 (3-Decanoyl-(4-hydroxycoumarin) (5)) Show SMILES CCCCCCCCCC(=O)c1c(O)c2ccccc2oc1=O Show InChI InChI=1S/C19H24O4/c1-2-3-4-5-6-7-8-12-15(20)17-18(21)14-11-9-10-13-16(14)23-19(17)22/h9-11,13,21H,2-8,12H2,1H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.30E+4	n/a	n/a	n/a	n/a	n/a	30
COMSATS Institute of Information Technology					Assay Description Reaction mixtures comprising one unit of urease enzyme (B. pasteurii) solution and 55 µL of buffers containing 100 mMol urea were incubated with 5 µL...				Bioorg Chem 66: 111-6 (2016) Article DOI: 10.1016/j.bioorg.2016.04.005 BindingDB Entry DOI: 10.7270/Q2QZ28RQ
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173593 ((E)-2((E)-(4-Hydroxybenzylidin)hydrazono)thiazolid...) Show SMILES Oc1ccc(\C=N/N=C2\NC(=O)CS2)cc1 Show InChI InChI=1S/C10H9N3O2S/c14-8-3-1-7(2-4-8)5-11-13-10-12-9(15)6-16-10/h1-5,14H,6H2,(H,12,13,15)/b11-5-	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.46E+4	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM181104 (3-Lauroyl-(4-hydroxycoumarin) (6)) Show SMILES CCCCCCCCCCCC(=O)c1c(O)c2ccccc2oc1=O Show InChI InChI=1S/C21H28O4/c1-2-3-4-5-6-7-8-9-10-14-17(22)19-20(23)16-13-11-12-15-18(16)25-21(19)24/h11-13,15,23H,2-10,14H2,1H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.71E+4	n/a	n/a	n/a	n/a	n/a	30
COMSATS Institute of Information Technology					Assay Description Reaction mixtures comprising one unit of urease enzyme (B. pasteurii) solution and 55 µL of buffers containing 100 mMol urea were incubated with 5 µL...				Bioorg Chem 66: 111-6 (2016) Article DOI: 10.1016/j.bioorg.2016.04.005 BindingDB Entry DOI: 10.7270/Q2QZ28RQ
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM50229993 (2-thiourea | CHEMBL260876 | Thiocarbamid | Thiohar...) Show SMILES NC(N)=S Show InChI InChI=1S/CH4N2S/c2-1(3)4/h(H4,2,3,4)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL KEGG MMDB PC cid PC sid PDB UniChem Patents	Article PubMed	n/a	n/a	2.10E+4	n/a	n/a	n/a	n/a	n/a	30
COMSATS Institute of Information Technology					Assay Description Reaction mixtures comprising one unit of urease enzyme (B. pasteurii) solution and 55 µL of buffers containing 100 mMol urea were incubated with 5 µL...				Bioorg Chem 66: 111-6 (2016) Article DOI: 10.1016/j.bioorg.2016.04.005 BindingDB Entry DOI: 10.7270/Q2QZ28RQ
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM50229993 (2-thiourea | CHEMBL260876 | Thiocarbamid | Thiohar...) Show SMILES NC(N)=S Show InChI InChI=1S/CH4N2S/c2-1(3)4/h(H4,2,3,4)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL KEGG MMDB PC cid PC sid PDB UniChem Patents	Article PubMed	n/a	n/a	2.13E+4	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173592 ((E)-2-((E)-(3,5-Dichloro-2-hydroxybenzylidene)hydr...) Show SMILES Oc1c(Cl)cc(Cl)cc1\C=N\N=C1/NC(=O)CS1 Show InChI InChI=1S/C10H7Cl2N3O2S/c11-6-1-5(9(17)7(12)2-6)3-13-15-10-14-8(16)4-18-10/h1-3,17H,4H2,(H,14,15,16)/b13-3+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.67E+4	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173589 ((E)-2((E)-(4-Nitrobenzylidene)hydrazono)thiazolidi...) Show SMILES [O-][N+](=O)c1ccc(\C=N\N=C2/NC(=O)CS2)cc1 Show InChI InChI=1S/C10H8N4O3S/c15-9-6-18-10(12-9)13-11-5-7-1-3-8(4-2-7)14(16)17/h1-5H,6H2,(H,12,13,15)/b11-5+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.69E+4	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM181106 (3-(Methanesulfonoyl)-(4-hydroxycoumarin) (11)) Show SMILES CS(=O)(=O)c1c(O)c2ccccc2oc1=O Show InChI InChI=1S/C10H8O5S/c1-16(13,14)9-8(11)6-4-2-3-5-7(6)15-10(9)12/h2-5,11H,1H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.95E+4	n/a	n/a	n/a	n/a	n/a	30
COMSATS Institute of Information Technology					Assay Description Reaction mixtures comprising one unit of urease enzyme (B. pasteurii) solution and 55 µL of buffers containing 100 mMol urea were incubated with 5 µL...				Bioorg Chem 66: 111-6 (2016) Article DOI: 10.1016/j.bioorg.2016.04.005 BindingDB Entry DOI: 10.7270/Q2QZ28RQ
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM181102 (3-Nonanoyl-(4-hydroxycoumarin) (4)) Show SMILES CCCCCCCCC(=O)c1c(O)c2ccccc2oc1=O Show InChI InChI=1S/C18H22O4/c1-2-3-4-5-6-7-11-14(19)16-17(20)13-10-8-9-12-15(13)22-18(16)21/h8-10,12,20H,2-7,11H2,1H3	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.09E+4	n/a	n/a	n/a	n/a	n/a	30
COMSATS Institute of Information Technology					Assay Description Reaction mixtures comprising one unit of urease enzyme (B. pasteurii) solution and 55 µL of buffers containing 100 mMol urea were incubated with 5 µL...				Bioorg Chem 66: 111-6 (2016) Article DOI: 10.1016/j.bioorg.2016.04.005 BindingDB Entry DOI: 10.7270/Q2QZ28RQ
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173594 ((E)-2((E)-(3-Bromo-4,5-dimethoxybenzylidene)hydraz...) Show SMILES COc1cc(\C=N\N=C2/NC(=O)CS2)cc(Br)c1OC Show InChI InChI=1S/C12H12BrN3O3S/c1-18-9-4-7(3-8(13)11(9)19-2)5-14-16-12-15-10(17)6-20-12/h3-5H,6H2,1-2H3,(H,15,16,17)/b14-5+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.66E+4	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173596 ((E)-2-((E)-(4-Hyrazoxy-3,5-dimethoxybenzylidene)hy...) Show SMILES COc1cc(\C=N\N=C2/NC(=O)CS2)cc(OC)c1O Show InChI InChI=1S/C12H15N5O4S/c1-19-8-3-7(4-9(20-2)11(8)21-17-13)5-14-16-12-15-10(18)6-22-12/h3-5,17H,6,13H2,1-2H3,(H,15,16,18)/b14-5+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.79E+4	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173600 ((E)-2-((E)-(4-(Benzyloxy)benzylidene)hydrazono)thi...) Show SMILES O=Cc1ccc(\C=N\N=C2/NC(=O)CS2)cc1 Show InChI InChI=1S/C17H15N3O2S/c21-16-12-23-17(19-16)20-18-10-13-6-8-15(9-7-13)22-11-14-4-2-1-3-5-14/h1-10H,11-12H2,(H,19,20,21)/b18-10+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	3.92E+4	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173601 ((2Z)-2,20(Z)-(1,4-Phenylenebis(methane-1-yl-yliden...) Show SMILES Cc1ccc(\C=N/N=C2\NC(=O)CS2)cc1 Show InChI InChI=1S/C11H11N3OS/c1-8-2-4-9(5-3-8)6-12-14-11-13-10(15)7-16-11/h2-6H,7H2,1H3,(H,13,14,15)/b12-6-	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.39E+4	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173588 ((E)-2-((E)-(2-Nitrobenzylidene)hydrazono)thiazolid...) Show SMILES [O-][N+](=O)c1ccccc1\C=N\N=C1/NC(=O)CS1 Show InChI InChI=1S/C10H8N4O3S/c15-9-6-18-10(12-9)13-11-5-7-3-1-2-4-8(7)14(16)17/h1-5H,6H2,(H,12,13,15)/b11-5+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.75E+4	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173598 (4-((E)-((E)-(4-Oxothiazolidin-2-ylidene)hydrazono)...) Show SMILES COc1cc(\C=N\N=C2/NC(=O)CS2)ccc1OCc1ccccc1 Show InChI InChI=1S/C11H9N3O2S/c15-6-9-3-1-8(2-4-9)5-12-14-11-13-10(16)7-17-11/h1-6H,7H2,(H,13,14,16)/b12-5+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	4.85E+4	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173603 ((E)-2-(E)-((1H-Indole-3-yl)methylene)hydrazono)thi...) Show SMILES O=C1CS\C(N1)=N\N=C/C1C=Nc2ccccc12 |c:11| Show InChI InChI=1S/C12H10N4OS/c17-11-7-18-12(15-11)16-14-6-8-5-13-10-4-2-1-3-9(8)10/h1-6,8H,7H2,(H,15,16,17)/b14-6-	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.14E+4	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173591 ((E)-2-((E)-(2,3-Dimethoxybenzylidene)hydrazono)thi...) Show SMILES COc1cccc(\C=N\N=C2/NC(=O)CS2)c1OC Show InChI InChI=1S/C12H13N3O3S/c1-17-9-5-3-4-8(11(9)18-2)6-13-15-12-14-10(16)7-19-12/h3-6H,7H2,1-2H3,(H,14,15,16)/b13-6+	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	5.25E+4	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM181107 (3-(3-Nitrobenzosulfonyl)-(4-hydroxycoumarin) (14)) Show SMILES Oc1c(c(=O)oc2ccccc12)S(=O)(=O)Cc1cccc(c1)[N+]([O-])=O Show InChI InChI=1S/C16H11NO7S/c18-14-12-6-1-2-7-13(12)24-16(19)15(14)25(22,23)9-10-4-3-5-11(8-10)17(20)21/h1-8,18H,9H2	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.62E+4	n/a	n/a	n/a	n/a	n/a	30
COMSATS Institute of Information Technology					Assay Description Reaction mixtures comprising one unit of urease enzyme (B. pasteurii) solution and 55 µL of buffers containing 100 mMol urea were incubated with 5 µL...				Bioorg Chem 66: 111-6 (2016) Article DOI: 10.1016/j.bioorg.2016.04.005 BindingDB Entry DOI: 10.7270/Q2QZ28RQ
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173599 ((Z)-2-((Z)-(4-(Dimethyl amino)benzylodine)hydrazon...) Show SMILES COc1cc(\C=N/N=C2\NC(=O)CS2)ccc1OCc1ccccc1 Show InChI InChI=1S/C18H17N3O3S/c1-23-16-9-14(10-19-21-18-20-17(22)12-25-18)7-8-15(16)24-11-13-5-3-2-4-6-13/h2-10H,11-12H2,1H3,(H,20,21,22)/b19-10-	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.89E+4	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM181108 (3-(1-Naphthosulfonyl)-(4-hydroxycoumarin) (16)) Show SMILES Oc1c(c(=O)oc2ccccc12)S(=O)(=O)c1cccc2ccccc12 Show InChI InChI=1S/C19H12O5S/c20-17-14-9-3-4-10-15(14)24-19(21)18(17)25(22,23)16-11-5-7-12-6-1-2-8-13(12)16/h1-11,20H	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.95E+4	n/a	n/a	n/a	n/a	n/a	30
COMSATS Institute of Information Technology					Assay Description Reaction mixtures comprising one unit of urease enzyme (B. pasteurii) solution and 55 µL of buffers containing 100 mMol urea were incubated with 5 µL...				Bioorg Chem 66: 111-6 (2016) Article DOI: 10.1016/j.bioorg.2016.04.005 BindingDB Entry DOI: 10.7270/Q2QZ28RQ
					More data for this Ligand-Target Pair
Urease subunit alpha (Bacillus pasteurii)	BDBM173605 ((Z)-2-((Z)-(2,4-Dimethoxybenzoylidine)hydrazono)th...) Show SMILES COc1ccc(\C=N/N=C2\NC(=O)CS2)c(OC)c1 Show InChI InChI=1S/C12H13N3O3S/c1-17-9-4-3-8(10(5-9)18-2)6-13-15-12-14-11(16)7-19-12/h3-6H,7H2,1-2H3,(H,14,15,16)/b13-6-	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.97E+4	n/a	n/a	n/a	n/a	7.0	n/a
Hazara University					Assay Description This assay was modified from Berthelot assay and was employed for the determination of urease activity. The assay is based on the hydrolysis of urea ...				Bioorg Chem 63: 123-31 (2015) Article DOI: 10.1016/j.bioorg.2015.10.005 BindingDB Entry DOI: 10.7270/Q2H130RM
					More data for this Ligand-Target Pair