BDBM50423877 DIHYDROTANSHINONE::Dihydrotanshinone I::acs.jmedchem.1c00409_ST.562

SMILES C[C@H]1COC2=C1C(=O)C(=O)c1c2ccc2c(C)cccc12

InChI Key InChIKey=HARGZZNYNSYSGJ-JTQLQIEISA-N

Data  10 KI  14 IC50

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 5 hits for monomerid = 50423877   

TargetAcetylcholinesterase(Homo sapiens (Human))
New York Structural Biology Center

Curated by ChEMBL
LigandPNGBDBM50423877(DIHYDROTANSHINONE | Dihydrotanshinone I | acs.jmed...)
Affinity DataKi:  600nMAssay Description:Inhibition of human acetylcholinesteraseMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Homo sapiens (Human))
New York Structural Biology Center

Curated by ChEMBL
LigandPNGBDBM50423877(DIHYDROTANSHINONE | Dihydrotanshinone I | acs.jmed...)
Affinity DataKi:  750nM ΔG°:  -8.35kcal/molepH: 7.0 T: 2°CAssay Description:Assays were conducted at 25 C in 20 mM sodium phosphate buffer (pH 7.0) and 0.01% bovine serum albumin unless otherwise noted. AChE concentrations we...More data for this Ligand-Target Pair
TargetAcetylcholinesterase(Homo sapiens (Human))
New York Structural Biology Center

Curated by ChEMBL
LigandPNGBDBM50423877(DIHYDROTANSHINONE | Dihydrotanshinone I | acs.jmed...)
Affinity DataKi:  1.95E+3nMAssay Description:Inhibition of human AChE using acetylthiocholine as substrate by spectrophotometric assayMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Homo sapiens (Human))
New York Structural Biology Center

Curated by ChEMBL
LigandPNGBDBM50423877(DIHYDROTANSHINONE | Dihydrotanshinone I | acs.jmed...)
Affinity DataKi: >1.00E+5nMAssay Description:Inhibition of human BChE using butyrylthiocholine as substrate by spectrophotometric assayMore data for this Ligand-Target Pair
TargetAcetylcholinesterase(Homo sapiens (Human))
New York Structural Biology Center

Curated by ChEMBL
LigandPNGBDBM50423877(DIHYDROTANSHINONE | Dihydrotanshinone I | acs.jmed...)
Affinity DataIC50:  1.00E+3nMAssay Description:Inhibition of acetylcholinesterase (unknown origin)More data for this Ligand-Target Pair