Compile Data Set for Download or QSAR

Found 32 hits of ic50 for UniProtKB: G4VFD7   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523223 (CHEMBL4540838) Show SMILES OC1=C(Nc2cccc(Cl)c2Cl)C(=O)c2ccccc2C1=O |c:1| Show InChI InChI=1S/C16H9Cl2NO3/c17-10-6-3-7-11(12(10)18)19-13-14(20)8-4-1-2-5-9(8)15(21)16(13)22/h1-7,19,22H	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50384788 (LAPACHOL) Show SMILES [#6]\[#6](-[#6])=[#6]/[#6]-[#6]-1-[#6](=O)-[#6](=O)-c2ccccc2-[#6]-1=O Show InChI InChI=1S/C15H14O3/c1-9(2)7-8-12-13(16)10-5-3-4-6-11(10)14(17)15(12)18/h3-7,12H,8H2,1-2H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	19	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523217 (CHEMBL155771) Show SMILES CC(C)CCC1=C(O)C(=O)c2ccccc2C1=O |c:5| Show InChI InChI=1S/C15H16O3/c1-9(2)7-8-12-13(16)10-5-3-4-6-11(10)14(17)15(12)18/h3-6,9,18H,7-8H2,1-2H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523213 (CHEMBL4452960) Show SMILES OC1=C(Nc2ccccc2Cl)C(=O)c2ccccc2C1=O |c:1| Show InChI InChI=1S/C16H10ClNO3/c17-11-7-3-4-8-12(11)18-13-14(19)9-5-1-2-6-10(9)15(20)16(13)21/h1-8,18,21H	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	78	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523227 (CHEMBL4472078) Show SMILES OC1=C(Nc2cccc(c2)C(F)(F)F)C(=O)c2ccccc2C1=O |c:1| Show InChI InChI=1S/C17H10F3NO3/c18-17(19,20)9-4-3-5-10(8-9)21-13-14(22)11-6-1-2-7-12(11)15(23)16(13)24/h1-8,21,24H	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	111	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523232 (CHEMBL4457147) Show SMILES OC1=C(Nc2cccc(Cl)c2)C(=O)c2ccccc2C1=O |c:1| Show InChI InChI=1S/C16H10ClNO3/c17-9-4-3-5-10(8-9)18-13-14(19)11-6-1-2-7-12(11)15(20)16(13)21/h1-8,18,21H	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	129	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523214 (CHEMBL4560384) Show SMILES OC1=C(Nc2ccc(Cl)cc2)C(=O)c2ccccc2C1=O |c:1| Show InChI InChI=1S/C16H10ClNO3/c17-9-5-7-10(8-6-9)18-13-14(19)11-3-1-2-4-12(11)15(20)16(13)21/h1-8,18,21H	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	185	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523224 (CHEMBL4474026) Show SMILES OC1=C(N2CCN(CC2)c2ccc(Cl)cc2)C(=O)c2ccccc2C1=O |c:1| Show InChI InChI=1S/C20H17ClN2O3/c21-13-5-7-14(8-6-13)22-9-11-23(12-10-22)17-18(24)15-3-1-2-4-16(15)19(25)20(17)26/h1-8,26H,9-12H2	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	227	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523225 (CHEMBL4527976) Show SMILES OC1=C(N2CCN(CC2)c2ccc(cc2)[N+]([O-])=O)C(=O)c2ccccc2C1=O |c:1| Show InChI InChI=1S/C20H17N3O5/c24-18-15-3-1-2-4-16(15)19(25)20(26)17(18)22-11-9-21(10-12-22)13-5-7-14(8-6-13)23(27)28/h1-8,26H,9-12H2	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	375	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50203188 (2-((1r,4r)-4-(4-chlorophenyl)cyclohexyl)-3-hydroxy...) Show SMILES Clc1ccc(cc1)[C@H]1CC[C@@H](CC1)C1C(=O)C(=O)c2ccccc2C1=O |r,wU:7.7,wD:10.14,(15.73,-5.45,;14.39,-6.22,;14.39,-7.76,;13.06,-8.53,;11.71,-7.75,;11.71,-6.23,;13.05,-5.45,;10.38,-8.52,;10.38,-10.06,;9.05,-10.83,;7.71,-10.05,;7.71,-8.53,;9.04,-7.76,;6.35,-10.84,;6.35,-12.37,;7.7,-13.16,;5.03,-13.14,;5.03,-14.7,;3.67,-12.36,;2.35,-13.13,;1.02,-12.36,;1.02,-10.81,;2.29,-10.08,;3.66,-10.88,;5.05,-10.07,;5.05,-8.52,)| Show InChI InChI=1S/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,19H,5-8H2/t13-,15-,19?	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	430	n/a	n/a	n/a	n/a	n/a	n/a
University of Turin (UniTo) Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH				Eur J Med Chem 183: (2019) Article DOI: 10.1016/j.ejmech.2019.111681 BindingDB Entry DOI: 10.7270/Q2MW2MK0
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50203188 (2-((1r,4r)-4-(4-chlorophenyl)cyclohexyl)-3-hydroxy...) Show SMILES Clc1ccc(cc1)[C@H]1CC[C@@H](CC1)C1C(=O)C(=O)c2ccccc2C1=O |r,wU:7.7,wD:10.14,(15.73,-5.45,;14.39,-6.22,;14.39,-7.76,;13.06,-8.53,;11.71,-7.75,;11.71,-6.23,;13.05,-5.45,;10.38,-8.52,;10.38,-10.06,;9.05,-10.83,;7.71,-10.05,;7.71,-8.53,;9.04,-7.76,;6.35,-10.84,;6.35,-12.37,;7.7,-13.16,;5.03,-13.14,;5.03,-14.7,;3.67,-12.36,;2.35,-13.13,;1.02,-12.36,;1.02,-10.81,;2.29,-10.08,;3.66,-10.88,;5.05,-10.07,;5.05,-8.52,)| Show InChI InChI=1S/C22H19ClO3/c23-16-11-9-14(10-12-16)13-5-7-15(8-6-13)19-20(24)17-3-1-2-4-18(17)21(25)22(19)26/h1-4,9-13,15,19H,5-8H2/t13-,15-,19?	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	432	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523215 (CHEMBL4586212) Show SMILES OC1=C(N2CCN(CC2)c2cccc(Cl)c2Cl)C(=O)c2ccccc2C1=O |c:1| Show InChI InChI=1S/C20H16Cl2N2O3/c21-14-6-3-7-15(16(14)22)23-8-10-24(11-9-23)17-18(25)12-4-1-2-5-13(12)19(26)20(17)27/h1-7,27H,8-11H2	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	436	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523228 (CHEMBL2041119) Show SMILES OC1=C(N2CCN(CC2)c2ccccc2)C(=O)c2ccccc2C1=O |c:1| Show InChI InChI=1S/C20H18N2O3/c23-18-15-8-4-5-9-16(15)19(24)20(25)17(18)22-12-10-21(11-13-22)14-6-2-1-3-7-14/h1-9,25H,10-13H2	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	711	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523230 (CHEMBL4566973) Show SMILES OC1=C(Nc2ccc(F)cc2)C(=O)c2ccccc2C1=O |c:1| Show InChI InChI=1S/C16H10FNO3/c17-9-5-7-10(8-6-9)18-13-14(19)11-3-1-2-4-12(11)15(20)16(13)21/h1-8,18,21H	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid PDB UniChem	PDB Article PubMed	n/a	n/a	1.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair				3D Structure (crystal)
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523229 (CHEMBL62718) Show SMILES CC(C)\C=C\C1=C(O)C(=O)c2ccccc2C1=O |c:5| Show InChI InChI=1S/C15H14O3/c1-9(2)7-8-12-13(16)10-5-3-4-6-11(10)14(17)15(12)18/h3-9,18H,1-2H3/b8-7+	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523221 (CHEMBL4546952) Show SMILES OC1=C(Nc2ccc3OCCOc3c2)C(=O)c2ccccc2C1=O |c:1| Show InChI InChI=1S/C18H13NO5/c20-16-11-3-1-2-4-12(11)17(21)18(22)15(16)19-10-5-6-13-14(9-10)24-8-7-23-13/h1-6,9,19,22H,7-8H2	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523218 (CHEMBL2408377) Show SMILES OC1=C(Nc2ccccc2)C(=O)c2ccccc2C1=O |c:1| Show InChI InChI=1S/C16H11NO3/c18-14-11-8-4-5-9-12(11)15(19)16(20)13(14)17-10-6-2-1-3-7-10/h1-9,17,20H	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.10E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523212 (CHEMBL4436314) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]-1=[#6](-[#8]-[#6]C#N)-[#6](=O)-c2ccccc2-[#6]-1=O |c:5| Show InChI InChI=1S/C17H15NO3/c1-11(2)7-8-14-15(19)12-5-3-4-6-13(12)16(20)17(14)21-10-9-18/h3-7H,8,10H2,1-2H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523219 (CHEMBL2408378) Show SMILES COc1ccc(NC2=C(O)C(=O)c3ccccc3C2=O)cc1 |c:7| Show InChI InChI=1S/C17H13NO4/c1-22-11-8-6-10(7-9-11)18-14-15(19)12-4-2-3-5-13(12)16(20)17(14)21/h2-9,18,21H,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	4.70E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523222 (CHEMBL4524841) Show SMILES OC1=C(Nc2ccc3OCOc3c2)C(=O)c2ccccc2C1=O |c:1| Show InChI InChI=1S/C17H11NO5/c19-15-10-3-1-2-4-11(10)16(20)17(21)14(15)18-9-5-6-12-13(7-9)23-8-22-12/h1-7,18,21H,8H2	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	5.50E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM22774 (1,4-Benzoquinone | Benzil-related compound, 53 | C...) Show SMILES O=C1C=CC(=O)C=C1 |c:2,6| Show InChI InChI=1S/C6H4O2/c7-5-1-2-6(8)4-3-5/h1-4H	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase CHEMBL MCE KEGG PC cid PC sid PDB UniChem Patents	Article PubMed	n/a	n/a	8.80E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523220 (CHEMBL2408379) Show SMILES Cc1cccc(C)c1NC1=C(O)C(=O)c2ccccc2C1=O |c:10| Show InChI InChI=1S/C18H15NO3/c1-10-6-5-7-11(2)14(10)19-15-16(20)12-8-3-4-9-13(12)17(21)18(15)22/h3-9,19,22H,1-2H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	9.90E+3	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM15339 (6-fluoro-2-[4-(2-fluorophenyl)phenyl]-3-methyl-qui...) Show SMILES Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1F Show InChI InChI=1S/C23H15F2NO2/c1-13-21(23(27)28)18-12-16(24)10-11-20(18)26-22(13)15-8-6-14(7-9-15)17-4-2-3-5-19(17)25/h2-12H,1H3,(H,27,28)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM15339 (6-fluoro-2-[4-(2-fluorophenyl)phenyl]-3-methyl-qui...) Show SMILES Cc1c(nc2ccc(F)cc2c1C(O)=O)-c1ccc(cc1)-c1ccccc1F Show InChI InChI=1S/C23H15F2NO2/c1-13-21(23(27)28)18-12-16(24)10-11-20(18)26-22(13)15-8-6-14(7-9-15)17-4-2-3-5-19(17)25/h2-12H,1H3,(H,27,28)	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	Article PubMed	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Turin (UniTo) Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH				Eur J Med Chem 183: (2019) Article DOI: 10.1016/j.ejmech.2019.111681 BindingDB Entry DOI: 10.7270/Q2MW2MK0
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50365231 (CHEMBL1738786 | US9238653, Table 5, Compound 7) Show SMILES Cc1cc(Nc2ccc(cc2)C(F)(F)F)n2nc(nc2n1)C(C)(F)F Show InChI InChI=1S/C15H12F5N5/c1-8-7-11(22-10-5-3-9(4-6-10)15(18,19)20)25-13(21-8)23-12(24-25)14(2,16)17/h3-7,22H,1-2H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	2.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Turin (UniTo) Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH				Eur J Med Chem 183: (2019) Article DOI: 10.1016/j.ejmech.2019.111681 BindingDB Entry DOI: 10.7270/Q2MW2MK0
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50049066 (2-Hydroxynaphthoquinone | CHEBI:44401 | Lawsone | ...) Show SMILES OC1=CC(=O)c2ccccc2C1=O |t:1| Show InChI InChI=1S/C10H6O3/c11-8-5-9(12)10(13)7-4-2-1-3-6(7)8/h1-5,12H	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase MCE KEGG PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	2.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523216 (CHEMBL2023282) Show SMILES [#6]\[#6](-[#6])=[#6]\[#6]-[#6]-1=[#6](-[#8]S(=O)(=O)c2ccc(-[#6])cc2)-[#6](=O)-c2ccccc2-[#6]-1=O |c:5| Show InChI InChI=1S/C22H20O5S/c1-14(2)8-13-19-20(23)17-6-4-5-7-18(17)21(24)22(19)27-28(25,26)16-11-9-15(3)10-12-16/h4-12H,13H2,1-3H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	3.14E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50018011 (Aubagio | CHEBI:68540 | HMR-1726 | TERIFLUNOMIDE) Show SMILES C\C(O)=C(/C#N)C(=O)Nc1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C12H9F3N2O2/c1-7(18)10(6-16)11(19)17-9-4-2-8(3-5-9)12(13,14)15/h2-5,18H,1H3,(H,17,19)/b10-7-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50018011 (Aubagio | CHEBI:68540 | HMR-1726 | TERIFLUNOMIDE) Show SMILES C\C(O)=C(/C#N)C(=O)Nc1ccc(cc1)C(F)(F)F Show InChI InChI=1S/C12H9F3N2O2/c1-7(18)10(6-16)11(19)17-9-4-2-8(3-5-9)12(13,14)15/h2-5,18H,1H3,(H,17,19)/b10-7-	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase MCE PC cid PC sid PDB UniChem Similars	Article PubMed	n/a	n/a	5.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
University of Turin (UniTo) Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH				Eur J Med Chem 183: (2019) Article DOI: 10.1016/j.ejmech.2019.111681 BindingDB Entry DOI: 10.7270/Q2MW2MK0
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM24780 (2-methyl-1,4-benzoquinone, 9 | 2-methylcyclohexa-2...) Show SMILES CC1=CC(=O)C=CC1=O |c:5,t:1| Show InChI InChI=1S/C7H6O2/c1-5-4-6(8)2-3-7(5)9/h2-4H,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	5.70E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523226 (CHEMBL4464250) Show SMILES CNC1=C(Cl)C(=O)c2ccccc2C1=O |c:2| Show InChI InChI=1S/C11H8ClNO2/c1-13-9-8(12)10(14)6-4-2-3-5-7(6)11(9)15/h2-5,13H,1H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair
Dihydroorotate dehydrogenase (quinone), mitochondrial (Schistosoma mansoni)	BDBM50523231 (CHEMBL2252966) Show SMILES CC(C)(C)C1=CC(=O)C=CC1=O |c:8,t:4| Show InChI InChI=1S/C10H12O2/c1-10(2,3)8-6-7(11)4-5-9(8)12/h4-6H,1-3H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase MCE PC cid PC sid UniChem	Article PubMed	n/a	n/a	7.68E+5	n/a	n/a	n/a	n/a	n/a	n/a
Universidade de S£o Paulo Curated by ChEMBL					Assay Description Inhibition of Schistosoma mansoni DHODH using DHO as substrate measured at 4 secs interval for 60 secs by DCIP reduction based indirect assay				Eur J Med Chem 167: 357-366 (2019) Article DOI: 10.1016/j.ejmech.2019.02.018 BindingDB Entry DOI: 10.7270/Q2XK8JZ2
					More data for this Ligand-Target Pair