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4 similar compounds to monomer 31700

Compile data set for download or QSAR
Wt: 339.3
BDBM40008
Wt: 325.3
BDBM40010
Wt: 383.4
BDBM40012
Wt: 397.4
BDBM53364

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 10 hits for monomerid = 40008,40010,40012,53364   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Estrogen receptor


(Homo sapiens (Human))
BDBM40008
PNG
((5Z)-5-(2-ethoxybenzylidene)-2-(2-furyl)[1,3]thiaz...)
Show SMILES CCOc1ccccc1C=c1sc2nc(nn2c1=O)-c1ccco1
Show InChI InChI=1S/C17H13N3O3S/c1-2-22-12-7-4-3-6-11(12)10-14-16(21)20-17(24-14)18-15(19-20)13-8-5-9-23-13/h3-10H,2H2,1H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



Emory University

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2QJ7FQ3
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM40010
PNG
((5Z)-2-(2-furyl)-5-(2-methoxybenzylidene)[1,3]thia...)
Show SMILES COc1ccccc1C=c1sc2nc(nn2c1=O)-c1ccco1
Show InChI InChI=1S/C16H11N3O3S/c1-21-11-6-3-2-5-10(11)9-13-15(20)19-16(23-13)17-14(18-19)12-7-4-8-22-12/h2-9H,1H3
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n/an/a 1.75E+4n/an/an/an/an/an/a



Emory University

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2QJ7FQ3
More data for this
Ligand-Target Pair
Estrogen receptor


(Homo sapiens (Human))
BDBM40012
PNG
((5Z)-5-(3,4-diethoxybenzylidene)-2-(2-furyl)[1,3]t...)
Show SMILES CCOc1ccc(C=c2sc3nc(nn3c2=O)-c2ccco2)cc1OCC
Show InChI InChI=1S/C19H17N3O4S/c1-3-24-13-8-7-12(10-15(13)25-4-2)11-16-18(23)22-19(27-16)20-17(21-22)14-6-5-9-26-14/h5-11H,3-4H2,1-2H3
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n/an/a>5.00E+4n/an/an/an/an/an/a



Emory University

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: John A. Katzenellenbogen, ...


PubChem Bioassay (2007)


BindingDB Entry DOI: 10.7270/Q2QJ7FQ3
More data for this
Ligand-Target Pair
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM40010
PNG
((5Z)-2-(2-furyl)-5-(2-methoxybenzylidene)[1,3]thia...)
Show SMILES COc1ccccc1C=c1sc2nc(nn2c1=O)-c1ccco1
Show InChI InChI=1S/C16H11N3O3S/c1-21-11-6-3-2-5-10(11)9-13-15(20)19-16(23-13)17-14(18-19)12-7-4-8-22-12/h2-9H,1H3
PDB
MMDB

NCI pathway
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KEGG

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n/an/a 7.38E+3n/an/an/an/an/an/a



Emory University

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
carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1 isoform 1


(Homo sapiens (Human))
BDBM40010
PNG
((5Z)-2-(2-furyl)-5-(2-methoxybenzylidene)[1,3]thia...)
Show SMILES COc1ccccc1C=c1sc2nc(nn2c1=O)-c1ccco1
Show InChI InChI=1S/C16H11N3O3S/c1-21-11-6-3-2-5-10(11)9-13-15(20)19-16(23-13)17-14(18-19)12-7-4-8-22-12/h2-9H,1H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

antibodypedia
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PC cid
PC sid
UniChem

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PCBioAssay
n/an/a 5.00E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2V986KM
More data for this
Ligand-Target Pair
RecName: Full=Zinc finger protein mex-5


(Caenorhabditis elegans)
BDBM53364
PNG
((5Z)-5-(3-ethoxy-4-propoxybenzylidene)-2-(2-furyl)...)
Show SMILES CCCOc1ccc(C=c2sc3nc(nn3c2=O)-c2ccco2)cc1OCC
Show InChI InChI=1S/C20H19N3O4S/c1-3-9-26-14-8-7-13(11-16(14)25-4-2)12-17-19(24)23-20(28-17)21-18(22-23)15-6-5-10-27-15/h5-8,10-12H,3-4,9H2,1-2H3
KEGG

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n/an/an/an/a 3.00E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: MLPCN maternal gene expression Project ID: 2024 Keywords: Zinc finger, C. elegans, maternal gene expression, RNA-protein interac...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2D798VP
More data for this
Ligand-Target Pair
POsterior Segregation family member (pos-1)


(Caenorhabditis elegans)
BDBM40012
PNG
((5Z)-5-(3,4-diethoxybenzylidene)-2-(2-furyl)[1,3]t...)
Show SMILES CCOc1ccc(C=c2sc3nc(nn3c2=O)-c2ccco2)cc1OCC
Show InChI InChI=1S/C19H17N3O4S/c1-3-24-13-8-7-12(10-15(13)25-4-2)11-16-18(23)22-19(27-16)20-17(21-22)14-6-5-9-26-14/h5-11H,3-4H2,1-2H3
PDB

KEGG

UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem

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PCBioAssay
n/an/an/an/a 3.00E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: MLPCN maternal gene expression Project ID: 2024 Keywords: Zinc finger, C. elegans, maternal gene expression, RNA-protein interac...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q28G8J4C
More data for this
Ligand-Target Pair
RecName: Full=Zinc finger protein mex-5


(Caenorhabditis elegans)
BDBM40012
PNG
((5Z)-5-(3,4-diethoxybenzylidene)-2-(2-furyl)[1,3]t...)
Show SMILES CCOc1ccc(C=c2sc3nc(nn3c2=O)-c2ccco2)cc1OCC
Show InChI InChI=1S/C19H17N3O4S/c1-3-24-13-8-7-12(10-15(13)25-4-2)11-16-18(23)22-19(27-16)20-17(21-22)14-6-5-9-26-14/h5-11H,3-4H2,1-2H3
KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem

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PCBioAssay
n/an/an/an/a 3.00E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: MLPCN maternal gene expression Project ID: 2024 Keywords: Zinc finger, C. elegans, maternal gene expression, RNA-protein interac...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2D798VP
More data for this
Ligand-Target Pair
NS3


(Hepatitis C virus)
BDBM40012
PNG
((5Z)-5-(3,4-diethoxybenzylidene)-2-(2-furyl)[1,3]t...)
Show SMILES CCOc1ccc(C=c2sc3nc(nn3c2=O)-c2ccco2)cc1OCC
Show InChI InChI=1S/C19H17N3O4S/c1-3-24-13-8-7-12(10-15(13)25-4-2)11-16-18(23)22-19(27-16)20-17(21-22)14-6-5-9-26-14/h5-11H,3-4H2,1-2H3
PDB
MMDB

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n/an/a 2.47E+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 (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2XS5ST3
More data for this
Ligand-Target Pair
POsterior Segregation family member (pos-1)


(Caenorhabditis elegans)
BDBM53364
PNG
((5Z)-5-(3-ethoxy-4-propoxybenzylidene)-2-(2-furyl)...)
Show SMILES CCCOc1ccc(C=c2sc3nc(nn3c2=O)-c2ccco2)cc1OCC
Show InChI InChI=1S/C20H19N3O4S/c1-3-9-26-14-8-7-13(11-16(14)25-4-2)12-17-19(24)23-20(28-17)21-18(22-23)15-6-5-10-27-15/h5-8,10-12H,3-4,9H2,1-2H3
PDB

KEGG

UniProtKB/TrEMBL

GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 3.00E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Broad Institute: MLPCN maternal gene expression Project ID: 2024 Keywords: Zinc finger, C. elegans, maternal gene expression, RNA-protein interac...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q28G8J4C
More data for this
Ligand-Target Pair