BDBM50026311 4-[4-(2,4-Diamino-pyrimidin-5-ylmethyl)-2,6-dimethoxy-phenoxy]-butyric acid::CHEMBL320596
SMILES: COc1cc(Cc2cnc(N)nc2N)cc(OC)c1OCCCC(O)=O
InChI Key: InChIKey=GMBNQAVADXFXRF-UHFFFAOYSA-N
Data: 1 KI
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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Dihydrofolate reductase (Escherichia coli) | BDBM50026311 (4-[4-(2,4-Diamino-pyrimidin-5-ylmethyl)-2,6-dimeth...) | MMDB NCI pathway Reactome pathway KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | PubMed | 5.20 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
TBA Curated by ChEMBL | Assay Description Relative Binding affinity against Dihydrofolate reductase of Escherichia coli | J Med Chem 28: 303-11 (1985) BindingDB Entry DOI: 10.7270/Q2J966Z0 | |||||||||||
More data for this Ligand-Target Pair |