BDBM50400462 CHEMBL2179031
SMILES: Cc1cn([C@H]2C[C@H](O)[C@@H](CNC(=O)c3ccc(cc3)[N+]([O-])=O)O2)c(=O)[nH]c1=O
InChI Key: InChIKey=QRTREGCJFWKNRZ-BFHYXJOUSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Thymidylate kinase, putative (Plasmodium falciparum (isolate 3D7)) | BDBM50400462 (CHEMBL2179031) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | 3.02E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
University of Dundee Curated by ChEMBL | Assay Description Inhibition of recombinant Plasmodium falciparum TMPK using TMP as substrate by pyruvate kinase and lactate dehydrogenase enzyme coupled assay | J Med Chem 55: 10948-57 (2012) Article DOI: 10.1021/jm301328h BindingDB Entry DOI: 10.7270/Q2H1334S | |||||||||||
More data for this Ligand-Target Pair |