BindingDB logo
myBDB logout

BDBM52862 (5Z)-1-benzyl-5-[(2,5-dimethoxyanilino)methylene]-2-thioxo-hexahydropyrimidine-4,6-quinone::(5Z)-1-benzyl-5-[(2,5-dimethoxyanilino)methylidene]-2-sulfanylidene-1,3-diazinane-4,6-dione::(5Z)-5-[(2,5-dimethoxyanilino)methylidene]-1-(phenylmethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione::(5Z)-5-[[(2,5-dimethoxyphenyl)amino]methylidene]-1-(phenylmethyl)-2-sulfanylidene-1,3-diazinane-4,6-dione::1-Benzyl-5-[1-(2,5-dimethoxy-phenylamino)-meth-(Z)-ylidene]-2-thioxo-dihydro-pyrimidine-4,6-dione::MLS000333612::SMR000437713::cid_5540081

SMILES: COc1ccc(OC)c(NC=C2C(=O)NC(=S)N(Cc3ccccc3)C2=O)c1

InChI Key: InChIKey=OYPIOUMSJHRHCA-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 52862   
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
RecName: Full=Zinc finger protein mex-5


(Caenorhabditis elegans)
BDBM52862
PNG
((5Z)-1-benzyl-5-[(2,5-dimethoxyanilino)methylene]-...)
Show SMILES COc1ccc(OC)c(NC=C2C(=O)NC(=S)N(Cc3ccccc3)C2=O)c1 |w:10.9|
Show InChI InChI=1S/C20H19N3O4S/c1-26-14-8-9-17(27-2)16(10-14)21-11-15-18(24)22-20(28)23(19(15)25)12-13-6-4-3-5-7-13/h3-11,21H,12H2,1-2H3,(H,22,24,28)
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
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/Q2D798VP
More data for this
Ligand-Target Pair
Dopamine receptor D2L/neurotensin receptor NTS1


(Homo sapiens (Human))
BDBM52862
PNG
((5Z)-1-benzyl-5-[(2,5-dimethoxyanilino)methylene]-...)
Show SMILES COc1ccc(OC)c(NC=C2C(=O)NC(=S)N(Cc3ccccc3)C2=O)c1 |w:10.9|
Show InChI InChI=1S/C20H19N3O4S/c1-26-14-8-9-17(27-2)16(10-14)21-11-15-18(24)22-20(28)23(19(15)25)12-13-6-4-3-5-7-13/h3-11,21H,12H2,1-2H3,(H,22,24,28)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 3.83E+4n/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/Q22N50RJ
More data for this
Ligand-Target Pair
streptokinase A precursor


(Streptococcus pyogenes M1 GAS)
BDBM52862
PNG
((5Z)-1-benzyl-5-[(2,5-dimethoxyanilino)methylene]-...)
Show SMILES COc1ccc(OC)c(NC=C2C(=O)NC(=S)N(Cc3ccccc3)C2=O)c1 |w:10.9|
Show InChI InChI=1S/C20H19N3O4S/c1-26-14-8-9-17(27-2)16(10-14)21-11-15-18(24)22-20(28)23(19(15)25)12-13-6-4-3-5-7-13/h3-11,21H,12H2,1-2H3,(H,22,24,28)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/an/an/a 1.50E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: Group A streptococcus, GAS, streptokinase, expression, virulence, inhibition, dose response, EC50 Assay Overview: The goal of this assa...


PubChem Bioassay (2009)


BindingDB Entry DOI: 10.7270/Q2736PBV
More data for this
Ligand-Target Pair
POsterior Segregation family member (pos-1)


(Caenorhabditis elegans)
BDBM52862
PNG
((5Z)-1-benzyl-5-[(2,5-dimethoxyanilino)methylene]-...)
Show SMILES COc1ccc(OC)c(NC=C2C(=O)NC(=S)N(Cc3ccccc3)C2=O)c1 |w:10.9|
Show InChI InChI=1S/C20H19N3O4S/c1-26-14-8-9-17(27-2)16(10-14)21-11-15-18(24)22-20(28)23(19(15)25)12-13-6-4-3-5-7-13/h3-11,21H,12H2,1-2H3,(H,22,24,28)
PDB

KEGG

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
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