BDBM50194428 CHEMBL221283::eupatoriopicrin
SMILES: C\C1=C/[C@H]2OC(=O)C(=C)[C@@H]2[C@@H](CC(C)=CCC1)OC(=O)C(\CO)=C\CO
InChI Key: InChIKey=VWJYWGYJIDQUEG-UWRPYMCXSA-N
Data: 2 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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
MurA (P. aeruginosa) (Pseudomonas aeruginosa (G-proteobacteria)) | BDBM50194428 (CHEMBL221283 | eupatoriopicrin) | PDB KEGG UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 1.98E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Saarland University Curated by ChEMBL | Assay Description Inhibition of Pseudomonas aeruginosa PAO1293 MurA in presence of UNAG | Bioorg Med Chem Lett 16: 5605-9 (2006) Article DOI: 10.1016/j.bmcl.2006.08.021 BindingDB Entry DOI: 10.7270/Q20Z742G | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
MurA (E. coli) (Escherichia coli K-12 (Enterobacteria)) | BDBM50194428 (CHEMBL221283 | eupatoriopicrin) | PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem Similars | Article PubMed | n/a | n/a | 3.27E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
Saarland University Curated by ChEMBL | Assay Description Inhibition of Escherichia coli K12 Mur A in presence of UNAG | Bioorg Med Chem Lett 16: 5605-9 (2006) Article DOI: 10.1016/j.bmcl.2006.08.021 BindingDB Entry DOI: 10.7270/Q20Z742G | |||||||||||
More data for this Ligand-Target Pair |