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BDBM114852 (2E)-2-(2-thenylidene)benzo[e]benzothiophen-1-one::(2E)-2-(thien-2-ylmethylene)naphtho[2,1-b]thiophen-1(2H)-one::(2E)-2-(thiophen-2-ylmethylidene)-1-benzo[e][1]benzothiolone::(2E)-2-(thiophen-2-ylmethylidene)benzo[e][1]benzothiol-1-one::MLS000584663::SMR000203626::cid_12004806

SMILES: O=C1\C(Sc2ccc3ccccc3c12)=C/c1cccs1

InChI Key: InChIKey=NYRSOTAWRKGABU-XNTDXEJSSA-N

Data: 2 IC50  1 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 3 hits for monomerid = 114852   
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
Oxysterols receptor LXR-beta


(Homo sapiens (Human))
BDBM114852
PNG
((2E)-2-(2-thenylidene)benzo[e]benzothiophen-1-one ...)
Show SMILES O=C1\C(Sc2ccc3ccccc3c12)=C/c1cccs1
Show InChI InChI=1S/C17H10OS2/c18-17-15(10-12-5-3-9-19-12)20-14-8-7-11-4-1-2-6-13(11)16(14)17/h1-10H/b15-10+
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 6.75E+4n/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 Affiliation: UT Southwestern Assay Provider: David Mangelsdorf,...


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2ZP44SP
More data for this
Ligand-Target Pair
Nuclear hormone receptor family member daf-12


(Caenorhabditis elegans)
BDBM114852
PNG
((2E)-2-(2-thenylidene)benzo[e]benzothiophen-1-one ...)
Show SMILES O=C1\C(Sc2ccc3ccccc3c12)=C/c1cccs1
Show InChI InChI=1S/C17H10OS2/c18-17-15(10-12-5-3-9-19-12)20-14-8-7-11-4-1-2-6-13(11)16(14)17/h1-10H/b15-10+
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 6.76E+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 Affiliation: UT Southwestern Assay Provider: David Mangelsdorf,...


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2736PK0
More data for this
Ligand-Target Pair
Oxysterols receptor LXR-beta


(Homo sapiens (Human))
BDBM114852
PNG
((2E)-2-(2-thenylidene)benzo[e]benzothiophen-1-one ...)
Show SMILES O=C1\C(Sc2ccc3ccccc3c12)=C/c1cccs1
Show InChI InChI=1S/C17H10OS2/c18-17-15(10-12-5-3-9-19-12)20-14-8-7-11-4-1-2-6-13(11)16(14)17/h1-10H/b15-10+
UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 6.76E+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 Affiliation: UT Southwestern Assay Provider: David Mangelsdorf,...


PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2TX3D2C
More data for this
Ligand-Target Pair