BDBM50156443 CHEMBL3785863
SMILES: OC(Cn1cc(\C=C2/C(=O)N(c3ccccc23)c2c(Cl)cccc2Cl)c2ccccc12)Cn1cc(\C=C2/C(=O)N(c3ccccc23)c2c(Cl)cccc2Cl)c2ccccc12
InChI Key: InChIKey=XDJLNDDYGGJARO-IEXCSMOPSA-N
Data: 1 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Dihydrofolate reductase (Homo sapiens (Human)) | BDBM50156443 (CHEMBL3785863) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Patents Similars | PubMed | n/a | n/a | 8.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Guru Nanak Dev University Curated by ChEMBL | Assay Description Inhibition of human DHFR assessed as conversion of dihydrofolic acid to tetrahydrfolic acid by enzyme immunoassay in presence of NADPH | Bioorg Med Chem Lett 26: 1936-40 (2016) BindingDB Entry DOI: 10.7270/Q2DB83RX | |||||||||||
More data for this Ligand-Target Pair |