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BDBM52754 3-amino-4-hydroxy-5-nitro-besylic acid::3-amino-4-hydroxy-5-nitrobenzenesulfonic acid::3-azanyl-5-nitro-4-oxidanyl-benzenesulfonic acid::MLS000776595::SMR000371835::cid_3844407

SMILES: Nc1cc(cc(c1O)[N+]([O-])=O)S(O)(=O)=O

InChI Key: InChIKey=RHPXYZMDLOJTFF-UHFFFAOYSA-N

Data: 5 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 7 hits for monomerid = 52754   
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
POsterior Segregation


(Caenorhabditis elegans)
BDBM52754
PNG
(3-amino-4-hydroxy-5-nitro-besylic acid | 3-amino-4...)
Show SMILES Nc1cc(cc(c1O)[N+]([O-])=O)S(O)(=O)=O
Show InChI InChI=1S/C6H6N2O6S/c7-4-1-3(15(12,13)14)2-5(6(4)9)8(10)11/h1-2,9H,7H2,(H,12,13,14)
PDB

KEGG

UniProtKB/TrEMBL

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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
Zinc finger protein mex-5


(Caenorhabditis elegans)
BDBM52754
PNG
(3-amino-4-hydroxy-5-nitro-besylic acid | 3-amino-4...)
Show SMILES Nc1cc(cc(c1O)[N+]([O-])=O)S(O)(=O)=O
Show InChI InChI=1S/C6H6N2O6S/c7-4-1-3(15(12,13)14)2-5(6(4)9)8(10)11/h1-2,9H,7H2,(H,12,13,14)
KEGG

UniProtKB/SwissProt

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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
DNA (cytosine-5)-methyltransferase 1


(Homo sapiens (Human))
BDBM52754
PNG
(3-amino-4-hydroxy-5-nitro-besylic acid | 3-amino-4...)
Show SMILES Nc1cc(cc(c1O)[N+]([O-])=O)S(O)(=O)=O
Show InChI InChI=1S/C6H6N2O6S/c7-4-1-3(15(12,13)14)2-5(6(4)9)8(10)11/h1-2,9H,7H2,(H,12,13,14)
PDB

UniProtKB/SwissProt

antibodypedia
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n/an/a 3.20E+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/Q2NC5ZRN
More data for this
Ligand-Target Pair
RNA-editing ligase 1, mitochondrial


(Trypanosoma brucei brucei)
BDBM52754
PNG
(3-amino-4-hydroxy-5-nitro-besylic acid | 3-amino-4...)
Show SMILES Nc1cc(cc(c1O)[N+]([O-])=O)S(O)(=O)=O
Show InChI InChI=1S/C6H6N2O6S/c7-4-1-3(15(12,13)14)2-5(6(4)9)8(10)11/h1-2,9H,7H2,(H,12,13,14)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
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n/an/a 4.99E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute Ass...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2P26WT9
More data for this
Ligand-Target Pair
1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase gamma-1 [1-999,I813T]


(Homo sapiens (Human))
BDBM52754
PNG
(3-amino-4-hydroxy-5-nitro-besylic acid | 3-amino-4...)
Show SMILES Nc1cc(cc(c1O)[N+]([O-])=O)S(O)(=O)=O
Show InChI InChI=1S/C6H6N2O6S/c7-4-1-3(15(12,13)14)2-5(6(4)9)8(10)11/h1-2,9H,7H2,(H,12,13,14)
PDB
MMDB

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UniChem

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n/an/a 3.97E+3n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute Ass...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2NC5ZV0
More data for this
Ligand-Target Pair
1-phosphatidylinositol 4,5-bisphosphate phosphodiesterase beta-3


(Homo sapiens (Human))
BDBM52754
PNG
(3-amino-4-hydroxy-5-nitro-besylic acid | 3-amino-4...)
Show SMILES Nc1cc(cc(c1O)[N+]([O-])=O)S(O)(=O)=O
Show InChI InChI=1S/C6H6N2O6S/c7-4-1-3(15(12,13)14)2-5(6(4)9)8(10)11/h1-2,9H,7H2,(H,12,13,14)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
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PCBioAssay
n/an/a 1.23E+5n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute Ass...


PubChem Bioassay (2014)


BindingDB Entry DOI: 10.7270/Q2S46QKQ
More data for this
Ligand-Target Pair
Neuropilin-1


(Homo sapiens (Human))
BDBM52754
PNG
(3-amino-4-hydroxy-5-nitro-besylic acid | 3-amino-4...)
Show SMILES Nc1cc(cc(c1O)[N+]([O-])=O)S(O)(=O)=O
Show InChI InChI=1S/C6H6N2O6S/c7-4-1-3(15(12,13)14)2-5(6(4)9)8(10)11/h1-2,9H,7H2,(H,12,13,14)
PDB
MMDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
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n/an/a>9.50E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2HM5725
More data for this
Ligand-Target Pair