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BDBM50101939 4-Chloro-3-nitro-benzenesulfonamide::CHEMBL51663

SMILES: NS(=O)(=O)c1ccc(Cl)c(c1)[N+]([O-])=O

InChI Key: InChIKey=SPZGXONNVLTQDE-UHFFFAOYSA-N

Data: 2 KI  1 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 3 hits for monomerid = 50101939   
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
Carbonic anhydrase 2


(Bos taurus)
BDBM50101939
PNG
(4-Chloro-3-nitro-benzenesulfonamide | CHEMBL51663)
Show SMILES NS(=O)(=O)c1ccc(Cl)c(c1)[N+]([O-])=O
Show InChI InChI=1S/C6H5ClN2O4S/c7-5-2-1-4(14(8,12)13)3-6(5)9(10)11/h1-3H,(H2,8,12,13)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
2n/an/an/an/an/an/an/an/a



The University of Tokushima Graduate School

Curated by ChEMBL


Assay Description
Binding affinity to bovine carbonic anhydrase 2


Bioorg Med Chem Lett 21: 141-4 (2010)


Article DOI: 10.1016/j.bmcl.2010.11.050
BindingDB Entry DOI: 10.7270/Q2K938T6
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Bos taurus)
BDBM50101939
PNG
(4-Chloro-3-nitro-benzenesulfonamide | CHEMBL51663)
Show SMILES NS(=O)(=O)c1ccc(Cl)c(c1)[N+]([O-])=O
Show InChI InChI=1S/C6H5ClN2O4S/c7-5-2-1-4(14(8,12)13)3-6(5)9(10)11/h1-3H,(H2,8,12,13)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
2n/an/an/an/an/an/an/an/a



The University of Tokushima Graduate School

Curated by ChEMBL


Assay Description
Binding affinity to bovine carbonic anhydrase 2


Bioorg Med Chem Lett 21: 141-4 (2010)


Article DOI: 10.1016/j.bmcl.2010.11.050
BindingDB Entry DOI: 10.7270/Q2K938T6
More data for this
Ligand-Target Pair
Vascular cell adhesion protein 1


(Homo sapiens (Human))
BDBM50101939
PNG
(4-Chloro-3-nitro-benzenesulfonamide | CHEMBL51663)
Show SMILES NS(=O)(=O)c1ccc(Cl)c(c1)[N+]([O-])=O
Show InChI InChI=1S/C6H5ClN2O4S/c7-5-2-1-4(14(8,12)13)3-6(5)9(10)11/h1-3H,(H2,8,12,13)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 4.00E+4n/an/an/an/an/an/a



AtheroGenics, Inc.

Curated by ChEMBL


Assay Description
Ability to inhibit expression of Vascular cell adhesion molecule 1


Bioorg Med Chem Lett 11: 1823-7 (2001)


BindingDB Entry DOI: 10.7270/Q2MC8Z86
More data for this
Ligand-Target Pair