Compile Data Set for Download or QSAR

Found 201 hits with Last Name = 'alvarez' and Initial = 'f'   

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
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50404028 (CHEMBL2021376) Show SMILES Nc1nc2c(nc(N)[nH]c2=O)n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C10H14N6O5/c11-9-14-6-3(7(20)15-9)13-10(12)16(6)8-5(19)4(18)2(1-17)21-8/h2,4-5,8,17-19H,1H2,(H2,12,13)(H3,11,14,15,20)/t2-,4-,5-,8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	7.00E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase of virulent strain RH (value indicates Non ...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112053 (1-(2-Methyl-thiazol-4-ylmethyl)-1H-benzoimidazole-...) Show SMILES Cc1nc(Cn2cnc3c2C(=O)C=CC3=O)cs1 |c:13| Show InChI InChI=1S/C12H9N3O2S/c1-7-14-8(5-18-7)4-15-6-13-11-9(16)2-3-10(17)12(11)15/h2-3,5-6H,4H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase of virulent strain RH (value indicates comp...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112053 (1-(2-Methyl-thiazol-4-ylmethyl)-1H-benzoimidazole-...) Show SMILES Cc1nc(Cn2cnc3c2C(=O)C=CC3=O)cs1 |c:13| Show InChI InChI=1S/C12H9N3O2S/c1-7-14-8(5-18-7)4-15-6-13-11-9(16)2-3-10(17)12(11)15/h2-3,5-6H,4H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	1.10E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase from cystic strain ME 49 (value indicates c...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50404028 (CHEMBL2021376) Show SMILES Nc1nc2c(nc(N)[nH]c2=O)n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C10H14N6O5/c11-9-14-6-3(7(20)15-9)13-10(12)16(6)8-5(19)4(18)2(1-17)21-8/h2,4-5,8,17-19H,1H2,(H2,12,13)(H3,11,14,15,20)/t2-,4-,5-,8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase of virulent strain RH (value indicates comp...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50404028 (CHEMBL2021376) Show SMILES Nc1nc2c(nc(N)[nH]c2=O)n1[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O |r| Show InChI InChI=1S/C10H14N6O5/c11-9-14-6-3(7(20)15-9)13-10(12)16(6)8-5(19)4(18)2(1-17)21-8/h2,4-5,8,17-19H,1H2,(H2,12,13)(H3,11,14,15,20)/t2-,4-,5-,8-/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	2.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase from cystic strain ME 49 (value indicates c...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112060 (1-Benzyl-2-methyl-1H-benzoimidazole-4,7-dione | CH...) Show SMILES Cc1nc2c(C(=O)C=CC2=O)n1Cc1ccccc1 |c:7| Show InChI InChI=1S/C15H12N2O2/c1-10-16-14-12(18)7-8-13(19)15(14)17(10)9-11-5-3-2-4-6-11/h2-8H,9H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.00E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase from cystic strain ME 49 (value indicates c...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112063 (1,2-Dibenzyl-1H-benzoimidazole-4,7-dione | CHEMBL1...) Show SMILES O=C1C=CC(=O)c2c1nc(Cc1ccccc1)n2Cc1ccccc1 |c:2| Show InChI InChI=1S/C21H16N2O2/c24-17-11-12-18(25)21-20(17)22-19(13-15-7-3-1-4-8-15)23(21)14-16-9-5-2-6-10-16/h1-12H,13-14H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	3.50E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase from cystic strain ME 49 (value indicates c...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112058 (1-(3-Fluoro-benzyl)-1H-benzoimidazole-4,7-dione | ...) Show SMILES Fc1cccc(Cn2cnc3c2C(=O)C=CC3=O)c1 |c:15| Show InChI InChI=1S/C14H9FN2O2/c15-10-3-1-2-9(6-10)7-17-8-16-13-11(18)4-5-12(19)14(13)17/h1-6,8H,7H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.20E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase from cystic strain ME 49 (value indicates N...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112056 (1H-Benzoimidazole-4,7-dione | CHEMBL314906) Show SMILES O=C1C=CC(=O)c2[nH]cnc12 |c:2| Show InChI InChI=1S/C7H4N2O2/c10-4-1-2-5(11)7-6(4)8-3-9-7/h1-3H,(H,8,9)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	5.50E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase from cystic strain ME 49 (value indicates N...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112062 (1-Butyl-1H-benzoimidazole-4,7-dione | CHEMBL174383) Show SMILES CCCCn1cnc2c1C(=O)C=CC2=O |c:12| Show InChI InChI=1S/C11H12N2O2/c1-2-3-6-13-7-12-10-8(14)4-5-9(15)11(10)13/h4-5,7H,2-3,6H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	5.60E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase from cystic strain ME 49 (value indicates c...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112055 (1-Benzyl-1H-benzoimidazole-4,7-dione | CHEMBL36927...) Show SMILES O=C1C=CC(=O)c2c1ncn2Cc1ccccc1 |c:2| Show InChI InChI=1S/C14H10N2O2/c17-11-6-7-12(18)14-13(11)15-9-16(14)8-10-4-2-1-3-5-10/h1-7,9H,8H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	5.80E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase from cystic strain ME 49 (value indicates N...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112063 (1,2-Dibenzyl-1H-benzoimidazole-4,7-dione | CHEMBL1...) Show SMILES O=C1C=CC(=O)c2c1nc(Cc1ccccc1)n2Cc1ccccc1 |c:2| Show InChI InChI=1S/C21H16N2O2/c24-17-11-12-18(25)21-20(17)22-19(13-15-7-3-1-4-8-15)23(21)14-16-9-5-2-6-10-16/h1-12H,13-14H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	6.70E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase of virulent strain RH (value indicates comp...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112055 (1-Benzyl-1H-benzoimidazole-4,7-dione | CHEMBL36927...) Show SMILES O=C1C=CC(=O)c2c1ncn2Cc1ccccc1 |c:2| Show InChI InChI=1S/C14H10N2O2/c17-11-6-7-12(18)14-13(11)15-9-16(14)8-10-4-2-1-3-5-10/h1-7,9H,8H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	6.70E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase from cystic strain ME 49 (value indicates N...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112059 (1-(4-Fluoro-benzyl)-1H-benzoimidazole-4,7-dione | ...) Show SMILES Fc1ccc(Cn2cnc3c2C(=O)C=CC3=O)cc1 |c:14| Show InChI InChI=1S/C14H9FN2O2/c15-10-3-1-9(2-4-10)7-17-8-16-13-11(18)5-6-12(19)14(13)17/h1-6,8H,7H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	7.80E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase of virulent strain RH (value indicates Non ...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112058 (1-(3-Fluoro-benzyl)-1H-benzoimidazole-4,7-dione | ...) Show SMILES Fc1cccc(Cn2cnc3c2C(=O)C=CC3=O)c1 |c:15| Show InChI InChI=1S/C14H9FN2O2/c15-10-3-1-2-9(6-10)7-17-8-16-13-11(18)4-5-12(19)14(13)17/h1-6,8H,7H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9.90E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase of virulent strain RH (value indicates Non ...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112059 (1-(4-Fluoro-benzyl)-1H-benzoimidazole-4,7-dione | ...) Show SMILES Fc1ccc(Cn2cnc3c2C(=O)C=CC3=O)cc1 |c:14| Show InChI InChI=1S/C14H9FN2O2/c15-10-3-1-9(2-4-10)7-17-8-16-13-11(18)5-6-12(19)14(13)17/h1-6,8H,7H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	9.90E+5	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase from cystic strain ME 49 (value indicates N...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112060 (1-Benzyl-2-methyl-1H-benzoimidazole-4,7-dione | CH...) Show SMILES Cc1nc2c(C(=O)C=CC2=O)n1Cc1ccccc1 |c:7| Show InChI InChI=1S/C15H12N2O2/c1-10-16-14-12(18)7-8-13(19)15(14)17(10)9-11-5-3-2-4-6-11/h2-8H,9H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.05E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase of virulent strain RH (value indicates comp...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112054 (1-(2-Fluoro-benzyl)-1H-benzoimidazole-4,7-dione | ...) Show SMILES Fc1ccccc1Cn1cnc2c1C(=O)C=CC2=O |c:17| Show InChI InChI=1S/C14H9FN2O2/c15-10-4-2-1-3-9(10)7-17-8-16-13-11(18)5-6-12(19)14(13)17/h1-6,8H,7H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.48E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase of virulent strain RH (value indicates Non ...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112054 (1-(2-Fluoro-benzyl)-1H-benzoimidazole-4,7-dione | ...) Show SMILES Fc1ccccc1Cn1cnc2c1C(=O)C=CC2=O |c:17| Show InChI InChI=1S/C14H9FN2O2/c15-10-4-2-1-3-9(10)7-17-8-16-13-11(18)5-6-12(19)14(13)17/h1-6,8H,7H2	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.50E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase from cystic strain ME 49 (value indicates N...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112056 (1H-Benzoimidazole-4,7-dione | CHEMBL314906) Show SMILES O=C1C=CC(=O)c2[nH]cnc12 |c:2| Show InChI InChI=1S/C7H4N2O2/c10-4-1-2-5(11)7-6(4)8-3-9-7/h1-3H,(H,8,9)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Patents	PubMed	1.65E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase from cystic strain ME 49 (value indicates N...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50366803 (CHEMBL3144000 | CHEMBL604829) Show SMILES Nc1nc(N)c2[nH]nc([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 |r| Show InChI InChI=1S/C10H14N6O4/c11-9-5-3(13-10(12)14-9)4(15-16-5)8-7(19)6(18)2(1-17)20-8/h2,6-8,17-19H,1H2,(H,15,16)(H4,11,12,13,14)/t2-,6-,7-,8?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.68E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase from cystic strain ME 49 (value indicates c...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50366803 (CHEMBL3144000 | CHEMBL604829) Show SMILES Nc1nc(N)c2[nH]nc([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1 |r| Show InChI InChI=1S/C10H14N6O4/c11-9-5-3(13-10(12)14-9)4(15-16-5)8-7(19)6(18)2(1-17)20-8/h2,6-8,17-19H,1H2,(H,15,16)(H4,11,12,13,14)/t2-,6-,7-,8?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	1.70E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase of virulent strain RH (value indicates comp...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50366805 (CHEMBL1688966 | CHEMBL603304) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ncc2c1nc[nH]c2=O |r| Show InChI InChI=1S/C10H12N4O5/c15-2-5-6(16)7(17)10(19-5)14-8-4(1-13-14)9(18)12-3-11-8/h1,3,5-7,10,15-17H,2H2,(H,11,12,18)/t5-,6-,7-,10?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	1.80E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase of virulent strain RH (value indicates comp...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50366805 (CHEMBL1688966 | CHEMBL603304) Show SMILES OC[C@H]1O[C@H]([C@H](O)[C@@H]1O)n1ncc2c1nc[nH]c2=O |r| Show InChI InChI=1S/C10H12N4O5/c15-2-5-6(16)7(17)10(19-5)14-8-4(1-13-14)9(18)12-3-11-8/h1,3,5-7,10,15-17H,2H2,(H,11,12,18)/t5-,6-,7-,10?/m1/s1	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	Purchase CHEMBL PC cid PC sid UniChem Similars	PubMed	2.00E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase of virulent strain RH (value indicates comp...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112057 (1-Methyl-1H-benzoimidazole-4,7-dione | CHEMBL42405...) Show SMILES Cn1cnc2c1C(=O)C=CC2=O |c:9| Show InChI InChI=1S/C8H6N2O2/c1-10-4-9-7-5(11)2-3-6(12)8(7)10/h2-4H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	2.21E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase of virulent strain RH (value indicates Non ...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112057 (1-Methyl-1H-benzoimidazole-4,7-dione | CHEMBL42405...) Show SMILES Cn1cnc2c1C(=O)C=CC2=O |c:9| Show InChI InChI=1S/C8H6N2O2/c1-10-4-9-7-5(11)2-3-6(12)8(7)10/h2-4H,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	2.21E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase from cystic strain ME 49 (value indicates c...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Purine nucleoside phosphorylase (Homo sapiens (Human))	BDBM50112062 (1-Butyl-1H-benzoimidazole-4,7-dione | CHEMBL174383) Show SMILES CCCCn1cnc2c1C(=O)C=CC2=O |c:12| Show InChI InChI=1S/C11H12N2O2/c1-2-3-6-13-7-12-10-8(14)4-5-9(15)11(10)13/h4-5,7H,2-3,6H2,1H3	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem	PubMed	2.96E+6	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Universit£ Lyon I Curated by ChEMBL					Assay Description Compound was evaluated for its binding affinity against Toxoplasma gondii purine nucleoside phosphorylase of virulent strain RH (value indicates Non ...				Bioorg Med Chem Lett 12: 977-9 (2002) BindingDB Entry DOI: 10.7270/Q2HM591J
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM611728 (US11718612, Example 1) Show SMILES Fc1cccc(Cn2nc3c(CCN(C3=O)c3cccc(Cl)c3F)c2Cl)c1F Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	13.1	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2JH3R91
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM611803 (3-Bromo-6-(3- chloro-2-fluoro- phenyl)-2-(2,5- dif...) Show SMILES Fc1ccc(F)c(Cn2nc3c(CCN(C3=O)c3cccc(Cl)c3F)c2Br)c1 Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	17.4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2JH3R91
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM611729 (US11718612, Example 2) Show SMILES Fc1c(Cl)cccc1N1CCc2c(Cl)n(Cc3ccccc3)nc2C1=O Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	17.4	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2JH3R91
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM607525 (US11690850, Example 39) Show SMILES Cc1c(Cl)c(=O)c(nn1-c1ccccc1)C(=O)NC1CCc2ccccc2NC1=O Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	18	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2MS3XVN
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM611747 (US11718612, Example 12) Show SMILES Fc1ccccc1Cn1cnc(n1)C(=O)Nc1cccc(Cl)c1F Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	18.6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2JH3R91
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM611784 (US11718612, Example 50) Show SMILES Fc1ccc(F)c(Cn2nc3c(CCN(C3=O)c3cccc(Cl)c3F)c2Cl)c1 Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	18.6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2JH3R91
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM607543 (US11690850, Example 57) Show SMILES Cc1cc(=O)c(nn1-c1ccc(F)cc1)C(=O)NC1CCc2ccccc2NC1=O Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	20	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2MS3XVN
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM611795 (US11718612, Example 57) Show SMILES COc1c2CCN(C(=O)c2nn1Cc1cc(F)ccc1F)c1cccc(Cl)c1F Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	22	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2JH3R91
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM607529 (US11690850, Example 43) Show SMILES Cc1c(Br)c(=O)c(nn1-c1ccccc1)C(=O)NC1CCc2cc(Br)ccc2NC1=O Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	23	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2MS3XVN
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM607540 (US11690850, Example 54) Show SMILES Cc1cc(=O)c(nn1-c1cccc(F)c1)C(=O)NC1CCc2ccccc2NC1=O Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	27	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2MS3XVN
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM607536 (US11690850, Example 50) Show SMILES CN1c2ncccc2OC[C@H](NC(=O)c2nn(c(C)cc2=O)-c2ccccc2)C1=O |r| Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2MS3XVN
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM607531 (US11690850, Example 45) Show SMILES CN1c2ccc(Cl)cc2CCC(NC(=O)c2nn(-c3ccccc3)c(C)c(Cl)c2=O)C1=O Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	28	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2MS3XVN
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM607554 (US11690850, Example 70) Show SMILES O=C(NC1CCc2ccccc2NC1=O)c1nn(-c2ccccc2)c2ccccc2c1=O Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	28.9	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2MS3XVN
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM607550 (US11690850, Example 66) Show SMILES Cc1cc(=O)c(nn1-c1ccc(Cl)cc1)C(=O)NC1CCc2ccccc2NC1=O Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	30.2	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2MS3XVN
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM611762 (1-benzyl-N-(3-chloro-2- fluorophenyl)-1H-1,2,4- tr...) Show SMILES Fc1c(Cl)cccc1NC(=O)c1ncn(Cc2ccccc2)n1 Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	30.6	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2JH3R91
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM607555 (US11690850, Example 71) Show SMILES Cc1ccc(cc1)-n1nc(C(=O)NC2CCc3ccccc3NC2=O)c(=O)cc1C Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	30.9	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2MS3XVN
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM607490 (US11690850, Example 1) Show SMILES Cc1cc(=O)c(nn1-c1ccccc1)C(=O)Nc1cccc(Cl)c1F Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	32	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2MS3XVN
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM611798 (US11718612, Example 87) Show SMILES Cc1ccc(Cn2cnc(n2)C(=O)Nc2cccc(Cl)c2F)cc1F Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	32.2	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2JH3R91
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM607541 (US11690850, Example 55) Show SMILES CN1c2ccc(cc2OC[C@H](NC(=O)c2nn(c(C)cc2=O)-c2ccccc2)C1=O)C#N |r| Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	33	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2MS3XVN
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM607544 (US11690850, Example 59) Show SMILES Cc1cc(=O)c(nn1-c1ccccc1F)C(=O)NC1CCc2ccccc2NC1=O Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	33.5	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2MS3XVN
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM611764 (N-(3-chloro-2- fluorophenyl)-1-(3- cyanobenzyl)-1H...) Show SMILES Fc1c(Cl)cccc1NC(=O)c1ncn(Cc2cccc(c2)C#N)n1 Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	34.1	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2JH3R91
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM607527 (US11690850, Example 41) Show SMILES CN1c2ccccc2CCC(NC(=O)c2nn(c(C)cc2=O)-c2ccccc2)C1=O Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	35	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2MS3XVN
					More data for this Ligand-Target Pair
Receptor-interacting serine/threonine-protein kinase 1 (Homo sapiens (Human))	BDBM607528 (US11690850, Example 42) Show SMILES Cc1c(Br)c(=O)c(nn1-c1ccccc1)C(=O)NC1CCc2ccccc2NC1=O Show InChI	PDB UniProtKB/SwissProt UniProtKB/TrEMBL antibodypedia GoogleScholar AffyNet	PC cid PC sid UniChem		n/a	n/a	36	n/a	n/a	n/a	n/a	n/a	n/a
TBA									Citation and Details BindingDB Entry DOI: 10.7270/Q2MS3XVN
					More data for this Ligand-Target Pair

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