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BDBM52888 CMLD003315::MLS000438845::SMR000452614::[3-[(E)-3-methoxyprop-1-enyl]-7-methyl-6,8-bis(oxidanylidene)isochromen-7-yl] cyclopentanecarboxylate::[3-[(E)-3-methoxyprop-1-enyl]-7-methyl-6,8-dioxoisochromen-7-yl] cyclopentanecarboxylate::cid_16745662::cyclopentanecarboxylic acid [3-[(E)-3-methoxyprop-1-enyl]-7-methyl-6,8-dioxo-2-benzopyran-7-yl] ester::cyclopentanecarboxylic acid [6,8-diketo-3-[(E)-3-methoxyprop-1-enyl]-7-methyl-isochromen-7-yl] ester

SMILES: COC\C=C\C1=CC2=CC(=O)C(C)(OC(=O)C3CCCC3)C(=O)C2=CO1

InChI Key: InChIKey=SKNPOQJMMFXCCV-VMPITWQZSA-N

Data: 3 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 5 hits for monomerid = 52888   
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)
BDBM52888
PNG
(CMLD003315 | MLS000438845 | SMR000452614 | [3-[(E)...)
Show SMILES COC\C=C\C1=CC2=CC(=O)C(C)(OC(=O)C3CCCC3)C(=O)C2=CO1 |c:25,t:5,7|
Show InChI InChI=1S/C20H22O6/c1-20(26-19(23)13-6-3-4-7-13)17(21)11-14-10-15(8-5-9-24-2)25-12-16(14)18(20)22/h5,8,10-13H,3-4,6-7,9H2,1-2H3/b8-5+
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
POsterior Segregation family member (pos-1)


(Caenorhabditis elegans)
BDBM52888
PNG
(CMLD003315 | MLS000438845 | SMR000452614 | [3-[(E)...)
Show SMILES COC\C=C\C1=CC2=CC(=O)C(C)(OC(=O)C3CCCC3)C(=O)C2=CO1 |c:25,t:5,7|
Show InChI InChI=1S/C20H22O6/c1-20(26-19(23)13-6-3-4-7-13)17(21)11-14-10-15(8-5-9-24-2)25-12-16(14)18(20)22/h5,8,10-13H,3-4,6-7,9H2,1-2H3/b8-5+
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
perilipin-5


(Homo sapiens (Human))
BDBM52888
PNG
(CMLD003315 | MLS000438845 | SMR000452614 | [3-[(E)...)
Show SMILES COC\C=C\C1=CC2=CC(=O)C(C)(OC(=O)C3CCCC3)C(=O)C2=CO1 |c:25,t:5,7|
Show InChI InChI=1S/C20H22O6/c1-20(26-19(23)13-6-3-4-7-13)17(21)11-14-10-15(8-5-9-24-2)25-12-16(14)18(20)22/h5,8,10-13H,3-4,6-7,9H2,1-2H3/b8-5+
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.75E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q24B2ZW9
More data for this
Ligand-Target Pair
perilipin-1


(Homo sapiens (Human))
BDBM52888
PNG
(CMLD003315 | MLS000438845 | SMR000452614 | [3-[(E)...)
Show SMILES COC\C=C\C1=CC2=CC(=O)C(C)(OC(=O)C3CCCC3)C(=O)C2=CO1 |c:25,t:5,7|
Show InChI InChI=1S/C20H22O6/c1-20(26-19(23)13-6-3-4-7-13)17(21)11-14-10-15(8-5-9-24-2)25-12-16(14)18(20)22/h5,8,10-13H,3-4,6-7,9H2,1-2H3/b8-5+
Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.45E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2CV4GBF
More data for this
Ligand-Target Pair
Hepatocyte nuclear factor 4-alpha


(Homo sapiens (Human))
BDBM52888
PNG
(CMLD003315 | MLS000438845 | SMR000452614 | [3-[(E)...)
Show SMILES COC\C=C\C1=CC2=CC(=O)C(C)(OC(=O)C3CCCC3)C(=O)C2=CO1 |c:25,t:5,7|
Show InChI InChI=1S/C20H22O6/c1-20(26-19(23)13-6-3-4-7-13)17(21)11-14-10-15(8-5-9-24-2)25-12-16(14)18(20)22/h5,8,10-13H,3-4,6-7,9H2,1-2H3/b8-5+
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.14E+4n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2736PH3
More data for this
Ligand-Target Pair