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BDBM53027 (5E)-1-(3-ethoxyphenyl)-5-(2-furanylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione::(5E)-1-(3-ethoxyphenyl)-5-(furan-2-ylmethylidene)-2-sulfanylidene-1,3-diazinane-4,6-dione::(5E)-5-(2-furfurylidene)-1-m-phenetyl-2-thioxo-hexahydropyrimidine-4,6-quinone::1-(3-ethoxyphenyl)-5-(2-furylmethylene)-2-thioxodihydro-4,6(1H,5H)-pyrimidinedione::MLS000974514::SMR000496840::cid_2258593

SMILES: CCOc1cccc(c1)N1C(=S)NC(=O)C(=Cc2ccco2)C1=O

InChI Key: InChIKey=MLDNPPVULZTXCG-UHFFFAOYSA-N

Data: 4 IC50  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 6 hits for monomerid = 53027   
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
POsterior Segregation family member (pos-1)


(Caenorhabditis elegans)
BDBM53027
PNG
((5E)-1-(3-ethoxyphenyl)-5-(2-furanylmethylidene)-2...)
Show SMILES CCOc1cccc(c1)N1C(=S)NC(=O)C(=Cc2ccco2)C1=O |w:16.17|
Show InChI InChI=1S/C17H14N2O4S/c1-2-22-12-6-3-5-11(9-12)19-16(21)14(15(20)18-17(19)24)10-13-7-4-8-23-13/h3-10H,2H2,1H3,(H,18,20,24)
PDB

KEGG

UniProtKB/TrEMBL

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


(Caenorhabditis elegans)
BDBM53027
PNG
((5E)-1-(3-ethoxyphenyl)-5-(2-furanylmethylidene)-2...)
Show SMILES CCOc1cccc(c1)N1C(=S)NC(=O)C(=Cc2ccco2)C1=O |w:16.17|
Show InChI InChI=1S/C17H14N2O4S/c1-2-22-12-6-3-5-11(9-12)19-16(21)14(15(20)18-17(19)24)10-13-7-4-8-23-13/h3-10H,2H2,1H3,(H,18,20,24)
KEGG

UniProtKB/SwissProt

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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
lens epithelium-derived growth factor p75


(Homo sapiens (Human))
BDBM53027
PNG
((5E)-1-(3-ethoxyphenyl)-5-(2-furanylmethylidene)-2...)
Show SMILES CCOc1cccc(c1)N1C(=S)NC(=O)C(=Cc2ccco2)C1=O |w:16.17|
Show InChI InChI=1S/C17H14N2O4S/c1-2-22-12-6-3-5-11(9-12)19-16(21)14(15(20)18-17(19)24)10-13-7-4-8-23-13/h3-10H,2H2,1H3,(H,18,20,24)
PDB
MMDB

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n/an/a 1.55E+3n/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) Affiliation: Ohio State University Assay Provider: Mam...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2KD1WKS
More data for this
Ligand-Target Pair
DNA (cytosine-5)-methyltransferase 1 (DNMT1)


(Homo sapiens (Human))
BDBM53027
PNG
((5E)-1-(3-ethoxyphenyl)-5-(2-furanylmethylidene)-2...)
Show SMILES CCOc1cccc(c1)N1C(=S)NC(=O)C(=Cc2ccco2)C1=O |w:16.17|
Show InChI InChI=1S/C17H14N2O4S/c1-2-22-12-6-3-5-11(9-12)19-16(21)14(15(20)18-17(19)24)10-13-7-4-8-23-13/h3-10H,2H2,1H3,(H,18,20,24)
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n/an/a 4.24E+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 (2012)


BindingDB Entry DOI: 10.7270/Q2NC5ZRN
More data for this
Ligand-Target Pair
lens epithelium-derived growth factor p75


(Homo sapiens (Human))
BDBM53027
PNG
((5E)-1-(3-ethoxyphenyl)-5-(2-furanylmethylidene)-2...)
Show SMILES CCOc1cccc(c1)N1C(=S)NC(=O)C(=Cc2ccco2)C1=O |w:16.17|
Show InChI InChI=1S/C17H14N2O4S/c1-2-22-12-6-3-5-11(9-12)19-16(21)14(15(20)18-17(19)24)10-13-7-4-8-23-13/h3-10H,2H2,1H3,(H,18,20,24)
PDB
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n/an/a 5.37E+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) Affiliation: Ohio State University Assay Provider: Mam...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2Q52N9H
More data for this
Ligand-Target Pair
carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1 isoform 1


(Homo sapiens (Human))
BDBM53027
PNG
((5E)-1-(3-ethoxyphenyl)-5-(2-furanylmethylidene)-2...)
Show SMILES CCOc1cccc(c1)N1C(=S)NC(=O)C(=Cc2ccco2)C1=O |w:16.17|
Show InChI InChI=1S/C17H14N2O4S/c1-2-22-12-6-3-5-11(9-12)19-16(21)14(15(20)18-17(19)24)10-13-7-4-8-23-13/h3-10H,2H2,1H3,(H,18,20,24)
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n/an/a 1.60E+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