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BDBM33167 4-(2-chloranyl-5-ethenylsulfinyl-4-nitro-thiophen-3-yl)morpholine::4-(2-chloro-4-nitro-5-vinylsulfinyl-3-thienyl)morpholine::4-(2-chloro-5-ethenylsulfinyl-4-nitro-3-thiophenyl)morpholine::4-(2-chloro-5-ethenylsulfinyl-4-nitrothiophen-3-yl)morpholine::4-[2-chloro-4-nitro-5-(vinylsulfinyl)-3-thienyl]morpholine::MLS000672192::SMR000293370::cid_2948526

SMILES: [O-][N+](=O)c1c(sc(Cl)c1N1CCOCC1)S(=O)C=C

InChI Key: InChIKey=JMYKVYIOIYMTPA-UHFFFAOYSA-N

Data: 2 EC50

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 = 33167   
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
Hsf1 protein


(Mus musculus)
BDBM33167
PNG
(4-(2-chloranyl-5-ethenylsulfinyl-4-nitro-thiophen-...)
Show SMILES [O-][N+](=O)c1c(sc(Cl)c1N1CCOCC1)S(=O)C=C
Show InChI InChI=1S/C10H11ClN2O4S2/c1-2-19(16)10-8(13(14)15)7(9(11)18-10)12-3-5-17-6-4-12/h2H,1,3-6H2
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 3.36E+3n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Heat Shock Factor-1 (HSF-1), Stress Response, MG132, NIH3T3, Luminescence Assay Overview: Confirmation testing of small molecules identifie...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2P55KXK
More data for this
Ligand-Target Pair
Bcl-2-related protein A1


(Homo sapiens (Human))
BDBM33167
PNG
(4-(2-chloranyl-5-ethenylsulfinyl-4-nitro-thiophen-...)
Show SMILES [O-][N+](=O)c1c(sc(Cl)c1N1CCOCC1)S(=O)C=C
Show InChI InChI=1S/C10H11ClN2O4S2/c1-2-19(16)10-8(13(14)15)7(9(11)18-10)12-3-5-17-6-4-12/h2H,1,3-6H2
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 850n/an/a7.44



NMMLSC

Curated by PubChem BioAssay


Assay Description
The multiplex is constructed by using beads for each protein target that have been labeled with varying intensities of red color, so that each assay ...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2CN728N
More data for this
Ligand-Target Pair