BDBM50149962 CHEMBL3770856
SMILES: C[C@@H](NC(=O)OC(C)(C)C)c1nc2ccc(F)cc2s1
InChI Key: InChIKey=FCPOJRLQTNEPSJ-UHFFFAOYSA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Acetylcholinesterase (Electrophorus electricus (Electric eel)) | BDBM50149962 (CHEMBL3770856) | UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | PubMed | n/a | n/a | 1.05E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Pardubice Curated by ChEMBL | Assay Description Inhibition of electric eel AChE by spectrophotometric-based Ellman's method | Bioorg Med Chem 24: 1560-72 (2016) BindingDB Entry DOI: 10.7270/Q2XW4MPW | |||||||||||
More data for this Ligand-Target Pair | |||||||||||||
Butyrylcholinesterase (BuChE) (Equus caballus (Horse)) | BDBM50149962 (CHEMBL3770856) | PDB UniProtKB/SwissProt GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | PubMed | n/a | n/a | 2.31E+4 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Pardubice Curated by ChEMBL | Assay Description Inhibition of equine serum BChE by spectrophotometric-based Ellman's method | Bioorg Med Chem 24: 1560-72 (2016) BindingDB Entry DOI: 10.7270/Q2XW4MPW | |||||||||||
More data for this Ligand-Target Pair |