BDBM80497 4-but-3-en-1-ynyl-1,1,2,5-tetramethyl-4-piperidin-1-iumol;iodide::4-but-3-en-1-ynyl-1,1,2,5-tetramethyl-piperidin-1-ium-4-ol;iodide::4-but-3-en-1-ynyl-1,1,2,5-tetramethylpiperidin-1-ium-4-ol;iodide::4-but-3-en-1-ynyl-4-hydroxy-1,1,2,5-tetramethylpiperidinium::MLS000727824::SMR000306521::cid_16192985

SMILES CC1C[N+](C)(C)C(C)CC1(O)C#CC=C

InChI Key InChIKey=AZFNTQRIGXUFRT-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 80497   

TargetDNA dC->dU-editing enzyme APOBEC-3A(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80497(SMR000306521 | cid_16192985 | 4-but-3-en-1-ynyl-4-...)
Affinity DataIC50: 1.97E+3nMT: 2°CAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/3/2011
Entry Details
PCBioAssay
TargetDNA dC->dU-editing enzyme APOBEC-3G(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80497(SMR000306521 | cid_16192985 | 4-but-3-en-1-ynyl-4-...)
Affinity DataIC50: 5.58E+3nMT: 2°CAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/3/2011
Entry Details
PCBioAssay
LigandPNGBDBM80497(SMR000306521 | cid_16192985 | 4-but-3-en-1-ynyl-4-...)
Affinity DataIC50: 7.57E+3nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/4/2012
Entry Details
PCBioAssay