BDBM80811 4-cycloheptyl-N-(1-pyridin-2-ylethylideneamino)piperazine-1-carbothioamide::4-cycloheptyl-N-[1-(2-pyridinyl)ethylideneamino]-1-piperazinecarbothioamide::4-cycloheptyl-N-[1-(2-pyridyl)ethylideneamino]piperazine-1-carbothioamide::MLS002701703::SMR001565300::cid_5130254

SMILES CC(=NNC(=S)N1CCN(CC1)C1CCCCCC1)c1ccccn1

InChI Key InChIKey=ZGAVNXQAROBPJG-UHFFFAOYSA-N

Data  2 EC50

  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 2 hits for monomerid = 80811   

TargetHexokinase HKDC1 [W721R](Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80811(cid_5130254 | SMR001565300 | MLS002701703 | 4-cycl...)
Affinity DataEC50:  8.14E+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:
8/3/2011
Entry Details
PCBioAssay
TargetHexokinase-1(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80811(cid_5130254 | SMR001565300 | MLS002701703 | 4-cycl...)
Affinity DataEC50: >8.00E+4nMAssay 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:
8/4/2011
Entry Details
PCBioAssay