Compile Data Set for Download or QSAR

Found 4 hits Enz. Inhib. hit(s) with Target = 'Dihydrofolate reductase' and Ligand = 'BDBM50041934'   

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
Dihydrofolate reductase (Escherichia coli)	BDBM50041934 (5-Methyl-6-(3,4,5-trimethoxy-benzyl)-thieno[2,3-d]...) Show SMILES COc1cc(Cc2sc3nc(N)nc(N)c3c2C)cc(OC)c1OC Show InChI InChI=1S/C17H20N4O3S/c1-8-12(25-16-13(8)15(18)20-17(19)21-16)7-9-5-10(22-2)14(24-4)11(6-9)23-3/h5-6H,7H2,1-4H3,(H4,18,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	630	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of dihydrofolate reductase in Toxoplasma gondii.				J Med Chem 36: 3103-12 (1993) BindingDB Entry DOI: 10.7270/Q23X85PX
					More data for this Ligand-Target Pair
Dihydrofolate reductase (Escherichia coli)	BDBM50041934 (5-Methyl-6-(3,4,5-trimethoxy-benzyl)-thieno[2,3-d]...) Show SMILES COc1cc(Cc2sc3nc(N)nc(N)c3c2C)cc(OC)c1OC Show InChI InChI=1S/C17H20N4O3S/c1-8-12(25-16-13(8)15(18)20-17(19)21-16)7-9-5-10(22-2)14(24-4)11(6-9)23-3/h5-6H,7H2,1-4H3,(H4,18,19,20,21)	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>8.00E+3	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Tested for inhibitory activity against dihydrofolate reductase in Beef liver				J Med Chem 36: 3103-12 (1993) BindingDB Entry DOI: 10.7270/Q23X85PX
					More data for this Ligand-Target Pair
Dihydrofolate reductase (Homo sapiens (Human))	BDBM50041934 (5-Methyl-6-(3,4,5-trimethoxy-benzyl)-thieno[2,3-d]...) Show SMILES COc1cc(Cc2sc3nc(N)nc(N)c3c2C)cc(OC)c1OC Show InChI InChI=1S/C17H20N4O3S/c1-8-12(25-16-13(8)15(18)20-17(19)21-16)7-9-5-10(22-2)14(24-4)11(6-9)23-3/h5-6H,7H2,1-4H3,(H4,18,19,20,21)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	>1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Tested for inhibitory activity against dihydrofolate reductase in human				J Med Chem 36: 3103-12 (1993) BindingDB Entry DOI: 10.7270/Q23X85PX
					More data for this Ligand-Target Pair
Dihydrofolate reductase (Rattus norvegicus (rat))	BDBM50041934 (5-Methyl-6-(3,4,5-trimethoxy-benzyl)-thieno[2,3-d]...) Show SMILES COc1cc(Cc2sc3nc(N)nc(N)c3c2C)cc(OC)c1OC Show InChI InChI=1S/C17H20N4O3S/c1-8-12(25-16-13(8)15(18)20-17(19)21-16)7-9-5-10(22-2)14(24-4)11(6-9)23-3/h5-6H,7H2,1-4H3,(H4,18,19,20,21)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	5.10E+4	n/a	n/a	n/a	n/a	n/a	n/a
Harvard Medical School Curated by ChEMBL					Assay Description Inhibition of rat liver dihydrofolate reductase.				J Med Chem 36: 3103-12 (1993) BindingDB Entry DOI: 10.7270/Q23X85PX
					More data for this Ligand-Target Pair