Compile Data Set for Download or QSAR

Found 8 hits Enz. Inhib. hit(s) with all data for assayid = 2 entry = 50032081   

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
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50324036 (2-[5-(2,4-Dimethoxy-phenyl)-1H-pyrazol-3-yl]-6-(2-...) Show SMILES COc1ccc(-c2cc([nH]n2)-c2c(OC)cc(OC)c(C3CCN(C)C3CO)c2O)c(OC)c1 Show InChI InChI=1S/C25H31N3O6/c1-28-9-8-16(19(28)13-29)23-21(33-4)12-22(34-5)24(25(23)30)18-11-17(26-27-18)15-7-6-14(31-2)10-20(15)32-3/h6-7,10-12,16,19,29-30H,8-9,13H2,1-5H3,(H,26,27)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	960	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Solapur University Curated by ChEMBL					Assay Description Inhibition of mashroom tyrosinase assessed as oxidation of L-DOPA				Bioorg Med Chem 18: 6149-55 (2010) Article DOI: 10.1016/j.bmc.2010.06.046 BindingDB Entry DOI: 10.7270/Q2GQ6XXR
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50324034 (2-[5-(2-Chloro-phenyl)-1H-pyrazol-3-yl]-6-(2-hydro...) Show SMILES COc1cc(OC)c(-c2cc(n[nH]2)-c2ccccc2Cl)c(O)c1C1CCN(C)C1CO Show InChI InChI=1S/C23H26ClN3O4/c1-27-9-8-14(18(27)12-28)21-19(30-2)11-20(31-3)22(23(21)29)17-10-16(25-26-17)13-6-4-5-7-15(13)24/h4-7,10-11,14,18,28-29H,8-9,12H2,1-3H3,(H,25,26)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.18E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Solapur University Curated by ChEMBL					Assay Description Inhibition of mashroom tyrosinase assessed as oxidation of L-DOPA				Bioorg Med Chem 18: 6149-55 (2010) Article DOI: 10.1016/j.bmc.2010.06.046 BindingDB Entry DOI: 10.7270/Q2GQ6XXR
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50324037 (2-[5-(4-Fluoro-phenyl)-1H-pyrazol-3-yl]-6-(2-hydro...) Show SMILES COc1cc(OC)c(-c2cc(n[nH]2)-c2ccc(F)cc2)c(O)c1C1CCN(C)C1CO Show InChI InChI=1S/C23H26FN3O4/c1-27-9-8-15(18(27)12-28)21-19(30-2)11-20(31-3)22(23(21)29)17-10-16(25-26-17)13-4-6-14(24)7-5-13/h4-7,10-11,15,18,28-29H,8-9,12H2,1-3H3,(H,25,26)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.26E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Solapur University Curated by ChEMBL					Assay Description Inhibition of mashroom tyrosinase assessed as oxidation of L-DOPA				Bioorg Med Chem 18: 6149-55 (2010) Article DOI: 10.1016/j.bmc.2010.06.046 BindingDB Entry DOI: 10.7270/Q2GQ6XXR
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50324035 (2-[5-(2-Chloro-4-nitro-phenyl)-1H-pyrazol-3-yl]-6-...) Show SMILES COc1cc(OC)c(-c2cc(n[nH]2)-c2ccc(cc2Cl)[N+]([O-])=O)c(O)c1C1CCN(C)C1CO Show InChI InChI=1S/C23H25ClN4O6/c1-27-7-6-14(18(27)11-29)21-19(33-2)10-20(34-3)22(23(21)30)17-9-16(25-26-17)13-5-4-12(28(31)32)8-15(13)24/h4-5,8-10,14,18,29-30H,6-7,11H2,1-3H3,(H,25,26)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	1.46E+4	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Solapur University Curated by ChEMBL					Assay Description Inhibition of mashroom tyrosinase assessed as oxidation of L-DOPA				Bioorg Med Chem 18: 6149-55 (2010) Article DOI: 10.1016/j.bmc.2010.06.046 BindingDB Entry DOI: 10.7270/Q2GQ6XXR
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50324036 (2-[5-(2,4-Dimethoxy-phenyl)-1H-pyrazol-3-yl]-6-(2-...) Show SMILES COc1ccc(-c2cc([nH]n2)-c2c(OC)cc(OC)c(C3CCN(C)C3CO)c2O)c(OC)c1 Show InChI InChI=1S/C25H31N3O6/c1-28-9-8-16(19(28)13-29)23-21(33-4)12-22(34-5)24(25(23)30)18-11-17(26-27-18)15-7-6-14(31-2)10-20(15)32-3/h6-7,10-12,16,19,29-30H,8-9,13H2,1-5H3,(H,26,27)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.84E+3	n/a	n/a	n/a	n/a	n/a	n/a
Solapur University Curated by ChEMBL					Assay Description Inhibition of mashroom tyrosinase assessed as oxidation of L-DOPA				Bioorg Med Chem 18: 6149-55 (2010) Article DOI: 10.1016/j.bmc.2010.06.046 BindingDB Entry DOI: 10.7270/Q2GQ6XXR
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50324037 (2-[5-(4-Fluoro-phenyl)-1H-pyrazol-3-yl]-6-(2-hydro...) Show SMILES COc1cc(OC)c(-c2cc(n[nH]2)-c2ccc(F)cc2)c(O)c1C1CCN(C)C1CO Show InChI InChI=1S/C23H26FN3O4/c1-27-9-8-15(18(27)12-28)21-19(30-2)11-20(31-3)22(23(21)29)17-10-16(25-26-17)13-4-6-14(24)7-5-13/h4-7,10-11,15,18,28-29H,8-9,12H2,1-3H3,(H,25,26)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.96E+4	n/a	n/a	n/a	n/a	n/a	n/a
Solapur University Curated by ChEMBL					Assay Description Inhibition of mashroom tyrosinase assessed as oxidation of L-DOPA				Bioorg Med Chem 18: 6149-55 (2010) Article DOI: 10.1016/j.bmc.2010.06.046 BindingDB Entry DOI: 10.7270/Q2GQ6XXR
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50324035 (2-[5-(2-Chloro-4-nitro-phenyl)-1H-pyrazol-3-yl]-6-...) Show SMILES COc1cc(OC)c(-c2cc(n[nH]2)-c2ccc(cc2Cl)[N+]([O-])=O)c(O)c1C1CCN(C)C1CO Show InChI InChI=1S/C23H25ClN4O6/c1-27-7-6-14(18(27)11-29)21-19(33-2)10-20(34-3)22(23(21)30)17-9-16(25-26-17)13-5-4-12(28(31)32)8-15(13)24/h4-5,8-10,14,18,29-30H,6-7,11H2,1-3H3,(H,25,26)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.15E+4	n/a	n/a	n/a	n/a	n/a	n/a
Solapur University Curated by ChEMBL					Assay Description Inhibition of mashroom tyrosinase assessed as oxidation of L-DOPA				Bioorg Med Chem 18: 6149-55 (2010) Article DOI: 10.1016/j.bmc.2010.06.046 BindingDB Entry DOI: 10.7270/Q2GQ6XXR
					More data for this Ligand-Target Pair
Polyphenol oxidase 2 (Agaricus bisporus (Common mushroom))	BDBM50324034 (2-[5-(2-Chloro-phenyl)-1H-pyrazol-3-yl]-6-(2-hydro...) Show SMILES COc1cc(OC)c(-c2cc(n[nH]2)-c2ccccc2Cl)c(O)c1C1CCN(C)C1CO Show InChI InChI=1S/C23H26ClN3O4/c1-27-9-8-14(18(27)12-28)21-19(30-2)11-20(31-3)22(23(21)29)17-10-16(25-26-17)13-6-4-5-7-15(13)24/h4-7,10-11,14,18,28-29H,8-9,12H2,1-3H3,(H,25,26)	UniProtKB/SwissProt GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	2.94E+4	n/a	n/a	n/a	n/a	n/a	n/a
Solapur University Curated by ChEMBL					Assay Description Inhibition of mashroom tyrosinase assessed as oxidation of L-DOPA				Bioorg Med Chem 18: 6149-55 (2010) Article DOI: 10.1016/j.bmc.2010.06.046 BindingDB Entry DOI: 10.7270/Q2GQ6XXR
					More data for this Ligand-Target Pair