BDBM50009675 CHEMBL3235230
SMILES: COc1ccc(CN2CCCCC2COc2ccc(cn2)C(=O)\C=N\O)cc1OC
InChI Key: InChIKey=FUCKKTWNTILSAJ-ZMOGYAJESA-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 |
---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Acetylcholinesterase (Homo sapiens (Human)) | BDBM50009675 (CHEMBL3235230) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL KEGG PC cid PC sid UniChem Similars | Article PubMed | 2.33E+5 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Southwest Research Institute Curated by ChEMBL | Assay Description Inhibition of human AChE using acetylthiocholine as substrate after 4 hrs by robotic spectrophotometric assay | Bioorg Med Chem Lett 24: 1711-4 (2014) Article DOI: 10.1016/j.bmcl.2014.02.049 BindingDB Entry DOI: 10.7270/Q280545W | |||||||||||
More data for this Ligand-Target Pair |