BDBM50041943 6-(2,5-Dimethoxy-benzyl)-5-methyl-thieno[2,3-d]pyrimidine-2,4-diamine::6-(2,5-dimethoxybenzyl)-5-methylthieno[2,3-d]pyrimidine-2,4-diamine::CHEMBL104787
SMILES: COc1ccc(OC)c(Cc2sc3nc(N)nc(N)c3c2C)c1
InChI Key: InChIKey=WVIZZYJRTWDOHO-UHFFFAOYSA-N
Data: 5 IC50
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 |
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Dihydrofolate Reductase (DHFR) (Escherichia coli) | BDBM50041943 (6-(2,5-Dimethoxy-benzyl)-5-methyl-thieno[2,3-d]pyr...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 70 | 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 (Homo sapiens (Human)) | BDBM50041943 (6-(2,5-Dimethoxy-benzyl)-5-methyl-thieno[2,3-d]pyr...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 730 | 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 | |||||||||||||
Bacterial dihydrofolate reductase (Escherichia coli) | BDBM50041943 (6-(2,5-Dimethoxy-benzyl)-5-methyl-thieno[2,3-d]pyr...) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 1.40E+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 Beef liver | J Med Chem 36: 3103-12 (1993) BindingDB Entry DOI: 10.7270/Q23X85PX | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dihydrofolate reductase (DHFR) (Toxoplasma gondii) | BDBM50041943 (6-(2,5-Dimethoxy-benzyl)-5-methyl-thieno[2,3-d]pyr...) | PDB UniProtKB/SwissProt UniProtKB/TrEMBL GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 70 | n/a | n/a | n/a | n/a | n/a | n/a |
Duquesne University Curated by ChEMBL | Assay Description Inhibition of Toxoplasma gondii dihydrofolate reductase | J Med Chem 51: 4589-600 (2008) Article DOI: 10.1021/jm800244v BindingDB Entry DOI: 10.7270/Q2ZW1MTV | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Dihydrofolate reductase (Rattus norvegicus (rat)) | BDBM50041943 (6-(2,5-Dimethoxy-benzyl)-5-methyl-thieno[2,3-d]pyr...) | PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | n/a | n/a | 400 | 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 |