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BDBM88781 2-{4-[(2-Hydroxy-benzoyl)-hydrazonomethyl]-2-methoxy-phenoxy}-N-phenyl-acetamide::MLS001212428::N-[(E)-[3-methoxy-4-(2-oxidanylidene-2-phenylazanyl-ethoxy)phenyl]methylideneamino]-2-oxidanyl-benzamide::N-[(E)-[4-(2-anilino-2-keto-ethoxy)-3-methoxy-benzylidene]amino]-2-hydroxy-benzamide::N-[(E)-[4-(2-anilino-2-oxoethoxy)-3-methoxyphenyl]methylideneamino]-2-hydroxybenzamide::SMR000515267::cid_9564308

SMILES: COc1cc(\C=N\NC(=O)c2ccccc2O)ccc1OCC(=O)Nc1ccccc1

InChI Key: InChIKey=IATCOYWEZCHKTF-ZVHZXABRSA-N

Data: 4 IC50

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 = 88781   
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
tyrosine-protein phosphatase non-receptor type 5 isoform a


(Homo sapiens (Human))
BDBM88781
PNG
(2-{4-[(2-Hydroxy-benzoyl)-hydrazonomethyl]-2-metho...)
Show SMILES COc1cc(\C=N\NC(=O)c2ccccc2O)ccc1OCC(=O)Nc1ccccc1
Show InChI InChI=1S/C23H21N3O5/c1-30-21-13-16(14-24-26-23(29)18-9-5-6-10-19(18)27)11-12-20(21)31-15-22(28)25-17-7-3-2-4-8-17/h2-14,27H,15H2,1H3,(H,25,28)(H,26,29)/b24-14+
PDB
MMDB

KEGG

UniProtKB/SwissProt

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UniChem

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PCBioAssay
n/an/a 2.62E+4n/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/Q2DV1HGT
More data for this
Ligand-Target Pair
tyrosine-protein phosphatase non-receptor type 5 isoform a


(Homo sapiens (Human))
BDBM88781
PNG
(2-{4-[(2-Hydroxy-benzoyl)-hydrazonomethyl]-2-metho...)
Show SMILES COc1cc(\C=N\NC(=O)c2ccccc2O)ccc1OCC(=O)Nc1ccccc1
Show InChI InChI=1S/C23H21N3O5/c1-30-21-13-16(14-24-26-23(29)18-9-5-6-10-19(18)27)11-12-20(21)31-15-22(28)25-17-7-3-2-4-8-17/h2-14,27H,15H2,1H3,(H,25,28)(H,26,29)/b24-14+
PDB
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KEGG

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B.MOAD
antibodypedia
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PC cid
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UniChem

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PCBioAssay
n/an/a 4.47E+4n/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/Q2KH0KWR
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 11


(Homo sapiens (Human))
BDBM88781
PNG
(2-{4-[(2-Hydroxy-benzoyl)-hydrazonomethyl]-2-metho...)
Show SMILES COc1cc(\C=N\NC(=O)c2ccccc2O)ccc1OCC(=O)Nc1ccccc1
Show InChI InChI=1S/C23H21N3O5/c1-30-21-13-16(14-24-26-23(29)18-9-5-6-10-19(18)27)11-12-20(21)31-15-22(28)25-17-7-3-2-4-8-17/h2-14,27H,15H2,1H3,(H,25,28)(H,26,29)/b24-14+
PDB
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n/an/a 1.25E+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/Q2T43RPN
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (Human))
BDBM88781
PNG
(2-{4-[(2-Hydroxy-benzoyl)-hydrazonomethyl]-2-metho...)
Show SMILES COc1cc(\C=N\NC(=O)c2ccccc2O)ccc1OCC(=O)Nc1ccccc1
Show InChI InChI=1S/C23H21N3O5/c1-30-21-13-16(14-24-26-23(29)18-9-5-6-10-19(18)27)11-12-20(21)31-15-22(28)25-17-7-3-2-4-8-17/h2-14,27H,15H2,1H3,(H,25,28)(H,26,29)/b24-14+
PDB
MMDB

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UniChem

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PCBioAssay
n/an/a 4.10E+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/Q2959G44
More data for this
Ligand-Target Pair