BDBM93090 Analogue of 1a, 8j
SMILES: CCCCS(=O)(=O)N(C)c1c(N)n(Cc2ccccc2)c(=O)[nH]c1=O
InChI Key: InChIKey=ILRSJTONHWLJFH-UHFFFAOYSA-N
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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Glucose-1-phosphate thymidylyltransferase (RmlA) (Pseudomonas aeruginosa) | BDBM93090 (Analogue of 1a, 8j) | PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | MMDB PC cid PC sid PDB UniChem Similars | PDB Article PubMed | n/a | n/a | 175 | n/a | n/a | n/a | n/a | n/a | n/a |
University of St. Andrews | Assay Description Inhibition assay using glucose-1-phosphate thymidylyltransferase (RmlA). | ACS Chem Biol 8: 387-96 (2013) Article DOI: 10.1021/cb300426u BindingDB Entry DOI: 10.7270/Q26D5RMP | |||||||||||
More data for this Ligand-Target Pair | 3D Structure (crystal) |