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BDBM67050 4-[(4-ethoxyphenoxy)methyl]-N'-[(Z)-2-pyrrolylidenemethyl]benzohydrazide::4-[(4-ethoxyphenoxy)methyl]-N'-[(Z)-pyrrol-2-ylidenemethyl]benzohydrazide::MLS002245189::SMR001308848::cid_42912529

SMILES: CCOc1ccc(OCc2ccc(cc2)C(=O)NN=Cc2ccc[nH]2)cc1

InChI Key: InChIKey=MCAAVPPQIPYHLA-OEAKJJBVSA-N

Data: 2 IC50  1 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 3 hits for monomerid = 67050   
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
Bcl-2-like protein 11


(Homo sapiens (Human))
BDBM67050
PNG
(4-[(4-ethoxyphenoxy)methyl]-N'-[(Z)-2-pyrrolyliden...)
Show SMILES CCOc1ccc(OCc2ccc(cc2)C(=O)NN=Cc2ccc[nH]2)cc1 |w:18.18|
Show InChI InChI=1S/C21H21N3O3/c1-2-26-19-9-11-20(12-10-19)27-15-16-5-7-17(8-6-16)21(25)24-23-14-18-4-3-13-22-18/h3-14,22H,2,15H2,1H3,(H,24,25)/b23-14+
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antibodypedia
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PC sid
UniChem

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PCBioAssay
n/an/an/an/a>3.50E+5n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Keywords: apoptosis, BH3 domain, Bcl2-A1, BIM, caspase, cancer Primary Collaborator: Todd Golub, Broad Institute, golub@broadinstitute.org Assay Over...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q24J0CKJ
More data for this
Ligand-Target Pair
Protein Wnt-3a


(Mus musculus)
BDBM67050
PNG
(4-[(4-ethoxyphenoxy)methyl]-N'-[(Z)-2-pyrrolyliden...)
Show SMILES CCOc1ccc(OCc2ccc(cc2)C(=O)NN=Cc2ccc[nH]2)cc1 |w:18.18|
Show InChI InChI=1S/C21H21N3O3/c1-2-26-19-9-11-20(12-10-19)27-15-16-5-7-17(8-6-16)21(25)24-23-14-18-4-3-13-22-18/h3-14,22H,2,15H2,1H3,(H,24,25)/b23-14+
PDB

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n/an/a 5.48E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q25B012X
More data for this
Ligand-Target Pair
Zinc finger protein GLI1


(Mus musculus)
BDBM67050
PNG
(4-[(4-ethoxyphenoxy)methyl]-N'-[(Z)-2-pyrrolyliden...)
Show SMILES CCOc1ccc(OCc2ccc(cc2)C(=O)NN=Cc2ccc[nH]2)cc1 |w:18.18|
Show InChI InChI=1S/C21H21N3O3/c1-2-26-19-9-11-20(12-10-19)27-15-16-5-7-17(8-6-16)21(25)24-23-14-18-4-3-13-22-18/h3-14,22H,2,15H2,1H3,(H,24,25)/b23-14+
PDB
MMDB

B.MOAD
GoogleScholar
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PC cid
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UniChem

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PCBioAssay
n/an/a 2.44E+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/Q2862F26
More data for this
Ligand-Target Pair