Compile Data Set for Download or QSAR

Found 33 hits with Last Name = 'farias' and Initial = 'cb'   

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
Thymidine phosphorylase (Homo sapiens (Human))	BDBM50443010 (CHEMBL3086510) Show SMILES Cc1cc(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C7H6N2O2/c1-4-2-6(10)9-7(11)5(4)3-8/h2H,1H3,(H2,9,10,11)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Inhibition of human thymidine phosphorylase				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Homo sapiens (Human))	BDBM50443014 (CHEMBL3086521) Show SMILES Cc1c(CNCCO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C10H13N3O3/c1-6-7(4-11)9(15)13-10(16)8(6)5-12-2-3-14/h12,14H,2-3,5H2,1H3,(H2,13,15,16)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Inhibition of human thymidine phosphorylase				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Homo sapiens (Human))	BDBM50443013 (CHEMBL3087491) Show SMILES Cc1c(CNC(CO)CO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C11H15N3O4/c1-6-8(2-12)10(17)14-11(18)9(6)3-13-7(4-15)5-16/h7,13,15-16H,3-5H2,1H3,(H2,14,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Inhibition of human thymidine phosphorylase				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Homo sapiens (Human))	BDBM50443012 (CHEMBL3087492) Show SMILES Cc1c(CNCC(O)CO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C11H15N3O4/c1-6-8(2-12)10(17)14-11(18)9(6)4-13-3-7(16)5-15/h7,13,15-16H,3-5H2,1H3,(H2,14,17,18)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Inhibition of human thymidine phosphorylase				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Homo sapiens (Human))	BDBM50443011 (CHEMBL3087493) Show SMILES CN(C)Cc1c(O)[nH]c(=O)c(C#N)c1C Show InChI InChI=1S/C10H13N3O2/c1-6-7(4-11)9(14)12-10(15)8(6)5-13(2)3/h5H2,1-3H3,(H2,12,14,15)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Inhibition of human thymidine phosphorylase				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Thymidine phosphorylase (Homo sapiens (Human))	BDBM50443015 (CHEMBL3086508) Show SMILES Oc1ccc(C#N)c(=O)[nH]1 Show InChI InChI=1S/C6H4N2O2/c7-3-4-1-2-5(9)8-6(4)10/h1-2H,(H2,8,9,10)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Inhibition of human thymidine phosphorylase				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443015 (CHEMBL3086508) Show SMILES Oc1ccc(C#N)c(=O)[nH]1 Show InChI InChI=1S/C6H4N2O2/c7-3-4-1-2-5(9)8-6(4)10/h1-2H,(H2,8,9,10)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	127	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 150 uM R1P by isothermal titration calori...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50026387 (1-((2-HYDROXYETHOXY)METHYL)-5-BENZYLPYRIMIDINE-2,4...) Show SMILES OCCOCn1cc(Cc2ccccc2)c(=O)[nH]c1=O Show InChI InChI=1S/C14H16N2O4/c17-6-7-20-10-16-9-12(13(18)15-14(16)19)8-11-4-2-1-3-5-11/h1-5,9,17H,6-8,10H2,(H,15,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 50 uM R1P by isothermal titration calorim...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair				3D Structure (crystal)
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443011 (CHEMBL3087493) Show SMILES CN(C)Cc1c(O)[nH]c(=O)c(C#N)c1C Show InChI InChI=1S/C10H13N3O2/c1-6-7(4-11)9(14)12-10(15)8(6)5-13(2)3/h5H2,1-3H3,(H2,12,14,15)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	7.40E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 50 uM R1P by isothermal titration calorim...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443012 (CHEMBL3087492) Show SMILES Cc1c(CNCC(O)CO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C11H15N3O4/c1-6-8(2-12)10(17)14-11(18)9(6)4-13-3-7(16)5-15/h7,13,15-16H,3-5H2,1H3,(H2,14,17,18)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	4.60E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 50 uM R1P by isothermal titration calorim...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443013 (CHEMBL3087491) Show SMILES Cc1c(CNC(CO)CO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C11H15N3O4/c1-6-8(2-12)10(17)14-11(18)9(6)3-13-7(4-15)5-16/h7,13,15-16H,3-5H2,1H3,(H2,14,17,18)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 50 uM R1P by isothermal titration calorim...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443014 (CHEMBL3086521) Show SMILES Cc1c(CNCCO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C10H13N3O3/c1-6-7(4-11)9(15)13-10(16)8(6)5-12-2-3-14/h12,14H,2-3,5H2,1H3,(H2,13,15,16)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.30E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 50 uM R1P by isothermal titration calorim...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443010 (CHEMBL3086510) Show SMILES Cc1cc(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C7H6N2O2/c1-4-2-6(10)9-7(11)5(4)3-8/h2H,1H3,(H2,9,10,11)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 50 uM R1P by isothermal titration calorim...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443015 (CHEMBL3086508) Show SMILES Oc1ccc(C#N)c(=O)[nH]1 Show InChI InChI=1S/C6H4N2O2/c7-3-4-1-2-5(9)8-6(4)10/h1-2H,(H2,8,9,10)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	108	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 50 uM R1P by isothermal titration calorim...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50026387 (1-((2-HYDROXYETHOXY)METHYL)-5-BENZYLPYRIMIDINE-2,4...) Show SMILES OCCOCn1cc(Cc2ccccc2)c(=O)[nH]c1=O Show InChI InChI=1S/C14H16N2O4/c17-6-7-20-10-16-9-12(13(18)15-14(16)19)8-11-4-2-1-3-5-11/h1-5,9,17H,6-8,10H2,(H,15,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	1.40E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-inorganic phosphate binary complex expressed in Escherichia coli Rosetta (DE3) by isothermal titration calo...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair				3D Structure (crystal)
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443011 (CHEMBL3087493) Show SMILES CN(C)Cc1c(O)[nH]c(=O)c(C#N)c1C Show InChI InChI=1S/C10H13N3O2/c1-6-7(4-11)9(14)12-10(15)8(6)5-13(2)3/h5H2,1-3H3,(H2,12,14,15)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	312	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-inorganic phosphate binary complex expressed in Escherichia coli Rosetta (DE3) by isothermal titration calo...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443012 (CHEMBL3087492) Show SMILES Cc1c(CNCC(O)CO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C11H15N3O4/c1-6-8(2-12)10(17)14-11(18)9(6)4-13-3-7(16)5-15/h7,13,15-16H,3-5H2,1H3,(H2,14,17,18)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	263	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-inorganic phosphate binary complex expressed in Escherichia coli Rosetta (DE3) by isothermal titration calo...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443013 (CHEMBL3087491) Show SMILES Cc1c(CNC(CO)CO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C11H15N3O4/c1-6-8(2-12)10(17)14-11(18)9(6)3-13-7(4-15)5-16/h7,13,15-16H,3-5H2,1H3,(H2,14,17,18)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	502	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-inorganic phosphate binary complex expressed in Escherichia coli Rosetta (DE3) by isothermal titration calo...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443014 (CHEMBL3086521) Show SMILES Cc1c(CNCCO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C10H13N3O3/c1-6-7(4-11)9(15)13-10(16)8(6)5-12-2-3-14/h12,14H,2-3,5H2,1H3,(H2,13,15,16)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	151	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-inorganic phosphate binary complex expressed in Escherichia coli Rosetta (DE3) by isothermal titration calo...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443010 (CHEMBL3086510) Show SMILES Cc1cc(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C7H6N2O2/c1-4-2-6(10)9-7(11)5(4)3-8/h2H,1H3,(H2,9,10,11)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.20E+4	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-inorganic phosphate binary complex expressed in Escherichia coli Rosetta (DE3) by isothermal titration calo...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50026387 (1-((2-HYDROXYETHOXY)METHYL)-5-BENZYLPYRIMIDINE-2,4...) Show SMILES OCCOCn1cc(Cc2ccccc2)c(=O)[nH]c1=O Show InChI InChI=1S/C14H16N2O4/c17-6-7-20-10-16-9-12(13(18)15-14(16)19)8-11-4-2-1-3-5-11/h1-5,9,17H,6-8,10H2,(H,15,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	1.20E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1 expressed in Escherichia coli Rosetta (DE3) by isothermal titration calorimetric analysis				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair				3D Structure (crystal)
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443011 (CHEMBL3087493) Show SMILES CN(C)Cc1c(O)[nH]c(=O)c(C#N)c1C Show InChI InChI=1S/C10H13N3O2/c1-6-7(4-11)9(14)12-10(15)8(6)5-13(2)3/h5H2,1-3H3,(H2,12,14,15)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	4.20E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1 expressed in Escherichia coli Rosetta (DE3) by isothermal titration calorimetric analysis				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443012 (CHEMBL3087492) Show SMILES Cc1c(CNCC(O)CO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C11H15N3O4/c1-6-8(2-12)10(17)14-11(18)9(6)4-13-3-7(16)5-15/h7,13,15-16H,3-5H2,1H3,(H2,14,17,18)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.00E+4	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1 expressed in Escherichia coli Rosetta (DE3) by isothermal titration calorimetric analysis				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443013 (CHEMBL3087491) Show SMILES Cc1c(CNC(CO)CO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C11H15N3O4/c1-6-8(2-12)10(17)14-11(18)9(6)3-13-7(4-15)5-16/h7,13,15-16H,3-5H2,1H3,(H2,14,17,18)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	5.30E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1 expressed in Escherichia coli Rosetta (DE3) by isothermal titration calorimetric analysis				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443014 (CHEMBL3086521) Show SMILES Cc1c(CNCCO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C10H13N3O3/c1-6-7(4-11)9(15)13-10(16)8(6)5-12-2-3-14/h12,14H,2-3,5H2,1H3,(H2,13,15,16)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.00E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1 expressed in Escherichia coli Rosetta (DE3) by isothermal titration calorimetric analysis				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443015 (CHEMBL3086508) Show SMILES Oc1ccc(C#N)c(=O)[nH]1 Show InChI InChI=1S/C6H4N2O2/c7-3-4-1-2-5(9)8-6(4)10/h1-2H,(H2,8,9,10)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	2.90E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1 expressed in Escherichia coli Rosetta (DE3) by isothermal titration calorimetric analysis				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443010 (CHEMBL3086510) Show SMILES Cc1cc(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C7H6N2O2/c1-4-2-6(10)9-7(11)5(4)3-8/h2H,1H3,(H2,9,10,11)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	40	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 150 uM R1P by isothermal titration calori...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443014 (CHEMBL3086521) Show SMILES Cc1c(CNCCO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C10H13N3O3/c1-6-7(4-11)9(15)13-10(16)8(6)5-12-2-3-14/h12,14H,2-3,5H2,1H3,(H2,13,15,16)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	3.80E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 150 uM R1P by isothermal titration calori...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443013 (CHEMBL3087491) Show SMILES Cc1c(CNC(CO)CO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C11H15N3O4/c1-6-8(2-12)10(17)14-11(18)9(6)3-13-7(4-15)5-16/h7,13,15-16H,3-5H2,1H3,(H2,14,17,18)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	7.00E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 150 uM R1P by isothermal titration calori...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443012 (CHEMBL3087492) Show SMILES Cc1c(CNCC(O)CO)c(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C11H15N3O4/c1-6-8(2-12)10(17)14-11(18)9(6)4-13-3-7(16)5-15/h7,13,15-16H,3-5H2,1H3,(H2,14,17,18)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	9.40E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 150 uM R1P by isothermal titration calori...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443011 (CHEMBL3087493) Show SMILES CN(C)Cc1c(O)[nH]c(=O)c(C#N)c1C Show InChI InChI=1S/C10H13N3O2/c1-6-7(4-11)9(14)12-10(15)8(6)5-13(2)3/h5H2,1-3H3,(H2,12,14,15)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	1.00E+4	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 150 uM R1P by isothermal titration calori...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50443010 (CHEMBL3086510) Show SMILES Cc1cc(O)[nH]c(=O)c1C#N Show InChI InChI=1S/C7H6N2O2/c1-4-2-6(10)9-7(11)5(4)3-8/h2H,1H3,(H2,9,10,11)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL MCE PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	n/a	20	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 200 uM R1P by isothermal titration calori...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair
Uridine phosphorylase 1 (Homo sapiens (Human))	BDBM50026387 (1-((2-HYDROXYETHOXY)METHYL)-5-BENZYLPYRIMIDINE-2,4...) Show SMILES OCCOCn1cc(Cc2ccccc2)c(=O)[nH]c1=O Show InChI InChI=1S/C14H16N2O4/c17-6-7-20-10-16-9-12(13(18)15-14(16)19)8-11-4-2-1-3-5-11/h1-5,9,17H,6-8,10H2,(H,15,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL DrugBank MCE MMDB PC cid PC sid PDB UniChem Patents Similars	PDB Article PubMed	n/a	n/a	n/a	6.60E+3	n/a	n/a	n/a	n/a	n/a
Pontifícia Universidade Católica do Rio Grande do Sul (PUCRS) Curated by ChEMBL					Assay Description Binding affinity to human recombinant UP1-R1P binary complex expressed in Escherichia coli Rosetta (DE3) at 150 uM R1P by isothermal titration calori...				J Med Chem 56: 8892-902 (2013) Article DOI: 10.1021/jm401389u BindingDB Entry DOI: 10.7270/Q2HX1F44
					More data for this Ligand-Target Pair				3D Structure (crystal)