BindingDB logo
myBDB logout

BDBM50453 3-nitro-4-(N'-piperonylidenehydrazino)benzenesulfonamide::4-[2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-3-nitro-benzenesulfonamide::4-[2-(1,3-benzodioxol-5-ylmethylidene)hydrazinyl]-3-nitrobenzenesulfonamide::MLS000417391::SMR000242627::cid_4418320

SMILES: NS(=O)(=O)c1ccc(N=NCc2ccc3OCOc3c2)c(c1)[N+]([O-])=O

InChI Key: InChIKey=XAAHNRBIIMJEOC-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 = 50453   
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
Voltage-gated calcium channel subunit alpha Cav2.2


(Homo sapiens (Human))
BDBM50453
PNG
(3-nitro-4-(N'-piperonylidenehydrazino)benzenesulfo...)
Show SMILES NS(=O)(=O)c1ccc(N=NCc2ccc3OCOc3c2)c(c1)[N+]([O-])=O |w:8.7|
Show InChI InChI=1S/C14H12N4O6S/c15-25(21,22)10-2-3-11(12(6-10)18(19)20)17-16-7-9-1-4-13-14(5-9)24-8-23-13/h1-6H,7-8H2,(H2,15,21,22)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.59E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute Network...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2PZ578V
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM50453
PNG
(3-nitro-4-(N'-piperonylidenehydrazino)benzenesulfo...)
Show SMILES NS(=O)(=O)c1ccc(N=NCc2ccc3OCOc3c2)c(c1)[N+]([O-])=O |w:8.7|
Show InChI InChI=1S/C14H12N4O6S/c15-25(21,22)10-2-3-11(12(6-10)18(19)20)17-16-7-9-1-4-13-14(5-9)24-8-23-13/h1-6H,7-8H2,(H2,15,21,22)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.75E+3n/an/an/an/an/an/a



Emory University Molecular Libraries Screening Center

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Nikolovska-Coleska, Univer...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q23X8539
More data for this
Ligand-Target Pair