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SMILES: O=C1C=CC(=O)c2c1ccc1c3ccc(OCc4ccccc4)cc3oc(=O)c21

InChI Key: InChIKey=BZTJRVCNFPFWRS-UHFFFAOYSA-N

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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50251696   
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
M-phase inducer phosphatase 3


(Homo sapiens (Human))
BDBM50251696
PNG
(CHEMBL4104313)
Show SMILES O=C1C=CC(=O)c2c1ccc1c3ccc(OCc4ccccc4)cc3oc(=O)c21 |c:2|
Show InChI InChI=1S/C24H14O5/c25-19-10-11-20(26)22-18(19)9-8-17-16-7-6-15(12-21(16)29-24(27)23(17)22)28-13-14-4-2-1-3-5-14/h1-12H,13H2
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 7.12E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of recombinant human full length GST-tagged CDC25C expressed in Escherichia coli BL21-DE3 pLysS using 3-O-methylfluorescein phosphate as s...


Eur J Med Chem 134: 316-333 (2017)


Article DOI: 10.1016/j.ejmech.2017.04.012
BindingDB Entry DOI: 10.7270/Q2WD4311
More data for this
Ligand-Target Pair
M-phase inducer phosphatase 1


(Homo sapiens (Human))
BDBM50251696
PNG
(CHEMBL4104313)
Show SMILES O=C1C=CC(=O)c2c1ccc1c3ccc(OCc4ccccc4)cc3oc(=O)c21 |c:2|
Show InChI InChI=1S/C24H14O5/c25-19-10-11-20(26)22-18(19)9-8-17-16-7-6-15(12-21(16)29-24(27)23(17)22)28-13-14-4-2-1-3-5-14/h1-12H,13H2
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.11E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of recombinant human full length GST-tagged CDC25A expressed in Escherichia coli BL21-DE3 pLysS using 3-O-methylfluorescein phosphate as s...


Eur J Med Chem 134: 316-333 (2017)


Article DOI: 10.1016/j.ejmech.2017.04.012
BindingDB Entry DOI: 10.7270/Q2WD4311
More data for this
Ligand-Target Pair