BindingDB logo
myBDB logout

BDBM61325 1-N,3-N-bis(2-hydroxy-5-nitrophenyl)benzene-1,3-dicarboxamide::MLS001008494::N,N'-bis(2-hydroxy-5-nitrophenyl)isophthalamide::N,N'-bis(2-hydroxy-5-nitro-phenyl)isophthalamide::N1,N3-bis(2-hydroxy-5-nitrophenyl)benzene-1,3-dicarboxamide::N1,N3-bis(5-nitro-2-oxidanyl-phenyl)benzene-1,3-dicarboxamide::SMR000495849::cid_3823676

SMILES: Oc1ccc(cc1NC(=O)c1cccc(c1)C(=O)Nc1cc(ccc1O)[N+]([O-])=O)[N+]([O-])=O

InChI Key: InChIKey=BFJXGNDCJKJBPA-UHFFFAOYSA-N

Data: 8 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 8 hits for monomerid = 61325   
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
poly(A) binding protein, cytoplasmic 1


(Homo sapiens (Human))
BDBM61325
PNG
(1-N,3-N-bis(2-hydroxy-5-nitrophenyl)benzene-1,3-di...)
Show SMILES Oc1ccc(cc1NC(=O)c1cccc(c1)C(=O)Nc1cc(ccc1O)[N+]([O-])=O)[N+]([O-])=O
Show InChI InChI=1S/C20H14N4O8/c25-17-6-4-13(23(29)30)9-15(17)21-19(27)11-2-1-3-12(8-11)20(28)22-16-10-14(24(31)32)5-7-18(16)26/h1-10,25-26H,(H,21,27)(H,22,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 8.96E+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 (2009)


BindingDB Entry DOI: 10.7270/Q2ZC819K
More data for this
Ligand-Target Pair
Eukaryotic translation initiation factor 4H


(Homo sapiens (Human))
BDBM61325
PNG
(1-N,3-N-bis(2-hydroxy-5-nitrophenyl)benzene-1,3-di...)
Show SMILES Oc1ccc(cc1NC(=O)c1cccc(c1)C(=O)Nc1cc(ccc1O)[N+]([O-])=O)[N+]([O-])=O
Show InChI InChI=1S/C20H14N4O8/c25-17-6-4-13(23(29)30)9-15(17)21-19(27)11-2-1-3-12(8-11)20(28)22-16-10-14(24(31)32)5-7-18(16)26/h1-10,25-26H,(H,21,27)(H,22,28)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 7.71E+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 (2009)


BindingDB Entry DOI: 10.7270/Q26W98HW
More data for this
Ligand-Target Pair
carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1 isoform 1


(Homo sapiens (Human))
BDBM61325
PNG
(1-N,3-N-bis(2-hydroxy-5-nitrophenyl)benzene-1,3-di...)
Show SMILES Oc1ccc(cc1NC(=O)c1cccc(c1)C(=O)Nc1cc(ccc1O)[N+]([O-])=O)[N+]([O-])=O
Show InChI InChI=1S/C20H14N4O8/c25-17-6-4-13(23(29)30)9-15(17)21-19(27)11-2-1-3-12(8-11)20(28)22-16-10-14(24(31)32)5-7-18(16)26/h1-10,25-26H,(H,21,27)(H,22,28)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.03E+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 (2011)


BindingDB Entry DOI: 10.7270/Q2V986KM
More data for this
Ligand-Target Pair
Hematopoietic cell protein-tyrosine phosphatase 70Z-PEP


(Homo sapiens (Human))
BDBM61325
PNG
(1-N,3-N-bis(2-hydroxy-5-nitrophenyl)benzene-1,3-di...)
Show SMILES Oc1ccc(cc1NC(=O)c1cccc(c1)C(=O)Nc1cc(ccc1O)[N+]([O-])=O)[N+]([O-])=O
Show InChI InChI=1S/C20H14N4O8/c25-17-6-4-13(23(29)30)9-15(17)21-19(27)11-2-1-3-12(8-11)20(28)22-16-10-14(24(31)32)5-7-18(16)26/h1-10,25-26H,(H,21,27)(H,22,28)
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 8.76E+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/Q2FQ9V6B
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (Human))
BDBM61325
PNG
(1-N,3-N-bis(2-hydroxy-5-nitrophenyl)benzene-1,3-di...)
Show SMILES Oc1ccc(cc1NC(=O)c1cccc(c1)C(=O)Nc1cc(ccc1O)[N+]([O-])=O)[N+]([O-])=O
Show InChI InChI=1S/C20H14N4O8/c25-17-6-4-13(23(29)30)9-15(17)21-19(27)11-2-1-3-12(8-11)20(28)22-16-10-14(24(31)32)5-7-18(16)26/h1-10,25-26H,(H,21,27)(H,22,28)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 509n/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
Tyrosine-protein phosphatase non-receptor type 11


(Homo sapiens (Human))
BDBM61325
PNG
(1-N,3-N-bis(2-hydroxy-5-nitrophenyl)benzene-1,3-di...)
Show SMILES Oc1ccc(cc1NC(=O)c1cccc(c1)C(=O)Nc1cc(ccc1O)[N+]([O-])=O)[N+]([O-])=O
Show InChI InChI=1S/C20H14N4O8/c25-17-6-4-13(23(29)30)9-15(17)21-19(27)11-2-1-3-12(8-11)20(28)22-16-10-14(24(31)32)5-7-18(16)26/h1-10,25-26H,(H,21,27)(H,22,28)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 456n/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
tyrosine-protein phosphatase non-receptor type 5 isoform a


(Homo sapiens (Human))
BDBM61325
PNG
(1-N,3-N-bis(2-hydroxy-5-nitrophenyl)benzene-1,3-di...)
Show SMILES Oc1ccc(cc1NC(=O)c1cccc(c1)C(=O)Nc1cc(ccc1O)[N+]([O-])=O)[N+]([O-])=O
Show InChI InChI=1S/C20H14N4O8/c25-17-6-4-13(23(29)30)9-15(17)21-19(27)11-2-1-3-12(8-11)20(28)22-16-10-14(24(31)32)5-7-18(16)26/h1-10,25-26H,(H,21,27)(H,22,28)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 7.05E+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/Q2KH0KWR
More data for this
Ligand-Target Pair
tyrosine-protein phosphatase non-receptor type 5 isoform a


(Homo sapiens (Human))
BDBM61325
PNG
(1-N,3-N-bis(2-hydroxy-5-nitrophenyl)benzene-1,3-di...)
Show SMILES Oc1ccc(cc1NC(=O)c1cccc(c1)C(=O)Nc1cc(ccc1O)[N+]([O-])=O)[N+]([O-])=O
Show InChI InChI=1S/C20H14N4O8/c25-17-6-4-13(23(29)30)9-15(17)21-19(27)11-2-1-3-12(8-11)20(28)22-16-10-14(24(31)32)5-7-18(16)26/h1-10,25-26H,(H,21,27)(H,22,28)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.98E+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/Q2DV1HGT
More data for this
Ligand-Target Pair