BDBM50008584 2-[3-(1-Methyl-piperidin-4-yl)-allylidene]-indan-1-one::CHEMBL155746
SMILES: CN1CCC(CC1)\C=C\C=C1/Cc2ccccc2C1=O
InChI Key: InChIKey=KMRNXXRTDCMBEZ-PSRLSNJGSA-N
Data: 1 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 (Homo sapiens (Human)) | BDBM50008584 (2-[3-(1-Methyl-piperidin-4-yl)-allylidene]-indan-1...) | PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet | CHEMBL PC cid PC sid UniChem | PubMed | n/a | n/a | 3 | n/a | n/a | n/a | n/a | n/a | n/a |
University of Illinois Curated by ChEMBL | Assay Description Inhibition of acetylcholinesterase activity | J Med Chem 35: 590-601 (1992) BindingDB Entry DOI: 10.7270/Q2VQ31NP | |||||||||||
More data for this Ligand-Target Pair |