BDBM45400 2-(2-ketobenzo[cd]indol-1-yl)-N-piperonyl-acetamide::MLS000049935::N-(1,3-benzodioxol-5-ylmethyl)-2-(2-oxidanylidenebenzo[cd]indol-1-yl)ethanamide::N-(1,3-benzodioxol-5-ylmethyl)-2-(2-oxo-1-benzo[cd]indolyl)acetamide::N-(1,3-benzodioxol-5-ylmethyl)-2-(2-oxobenzo[cd]indol-1(2H)-yl)acetamide::N-(1,3-benzodioxol-5-ylmethyl)-2-(2-oxobenzo[cd]indol-1-yl)acetamide::SMR000077033::cid_1090648

SMILES O=C(CN1C(=O)c2cccc3cccc1c23)NCc1ccc2OCOc2c1

InChI Key InChIKey=VIOFFMUTCIKSLZ-UHFFFAOYSA-N

Data  2 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 2 hits for monomerid = 45400   

TargetKallikrein-5(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45400BDBM45400(N-(1,3-benzodioxol-5-ylmethyl)-2-(2-oxobenzo[cd]in...)
Affinity DataIC50: 5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
6/8/2011
Entry Details
PCBioAssay
TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandChemical structure of BindingDB Monomer ID 45400BDBM45400(N-(1,3-benzodioxol-5-ylmethyl)-2-(2-oxobenzo[cd]in...)
Affinity DataIC50: 5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/27/2011
Entry Details
PCBioAssay