BDBM80814 MLS002701845::N'-(1-isoquinolin-1-ylethyl)-4-pyridin-2-yl-piperazine-1-carbothiohydrazide::N'-(1-isoquinolin-1-ylethyl)-4-pyridin-2-ylpiperazine-1-carbothiohydrazide::N'-[1-(1-isoquinolinyl)ethyl]-4-(2-pyridinyl)-1-piperazinecarbothiohydrazide::N'-[1-(1-isoquinolyl)ethyl]-4-(2-pyridyl)piperazine-1-carbothiohydrazide::SMR001565437::cid_3000691

SMILES CC(NNC(=S)N1CCN(CC1)c1ccccn1)c1nccc2ccccc12

InChI Key InChIKey=KLYOLLLMOLFUSQ-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 = 80814   

TargetHexokinase-1(Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80814(MLS002701845 | N'-(1-isoquinolin-1-ylethyl)-4-pyri...)
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
Ligand InfoPC cidPC sid
In DepthDetails PCBioAssay
TargetHexokinase HKDC1 [W721R](Homo sapiens (Human))
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80814(MLS002701845 | N'-(1-isoquinolin-1-ylethyl)-4-pyri...)
Affinity DataEC50:  2.19E+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
Ligand InfoPC cidPC sid
In DepthDetails PCBioAssay