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BDBM46576 3-oxidanidyl-7-phenyl-4,5-dihydro-1H-imidazo[4,5-g][2,1,3]benzoxadiazol-3-ium::3-oxido-7-phenyl-4,5-dihydro-1H-imidazo[4,5-g][2,1,3]benzoxadiazol-3-ium::MLS000689209::SMR000283296::cid_5400444

SMILES: On1[o+]nc-2c1CCc1nc([n-]c-21)-c1ccccc1

InChI Key: InChIKey=CXYYOOUZODTVNF-UHFFFAOYSA-N

Data: 2 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 46576   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Valosin-containing protein


(Homo sapiens (Human))
BDBM46576
PNG
(3-oxidanidyl-7-phenyl-4,5-dihydro-1H-imidazo[4,5-g...)
Show SMILES On1[o+]nc-2c1CCc1nc([n-]c-21)-c1ccccc1
Show InChI InChI=1S/C13H10N4O2/c18-17-10-7-6-9-11(12(10)16-19-17)15-13(14-9)8-4-2-1-3-5-8/h1-5,18H,6-7H2
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a>5.00E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2P26WJQ
More data for this
Ligand-Target Pair
Valosin-containing protein


(Homo sapiens (Human))
BDBM46576
PNG
(3-oxidanidyl-7-phenyl-4,5-dihydro-1H-imidazo[4,5-g...)
Show SMILES On1[o+]nc-2c1CCc1nc([n-]c-21)-c1ccccc1
Show InChI InChI=1S/C13H10N4O2/c18-17-10-7-6-9-11(12(10)16-19-17)15-13(14-9)8-4-2-1-3-5-8/h1-5,18H,6-7H2
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a>5.00E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute (TSRI) Assay...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2513WMG
More data for this
Ligand-Target Pair