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BDBM60287 2-nitro-N-(8-quinolinyl)benzenesulfonamide::2-nitro-N-(8-quinolyl)benzenesulfonamide::2-nitro-N-quinolin-8-yl-benzenesulfonamide::2-nitro-N-quinolin-8-ylbenzenesulfonamide::MLS001123640::SMR000658615::cid_739449

SMILES: [O-][N+](=O)c1ccccc1S(=O)(=O)Nc1cccc2cccnc12

InChI Key: InChIKey=YCXUFEOBLVZNAP-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 = 60287   
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
Kappa-type opioid receptor


(Homo sapiens (Human))
BDBM60287
PNG
(2-nitro-N-(8-quinolinyl)benzenesulfonamide | 2-nit...)
Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)Nc1cccc2cccnc12
Show InChI InChI=1S/C15H11N3O4S/c19-18(20)13-8-1-2-9-14(13)23(21,22)17-12-7-3-5-11-6-4-10-16-15(11)12/h1-10,17H
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n/an/a 7.84E+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/Q20C4T6J
More data for this
Ligand-Target Pair
p53-Binding Protein HDMX


(Homo sapiens (Human))
BDBM60287
PNG
(2-nitro-N-(8-quinolinyl)benzenesulfonamide | 2-nit...)
Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)Nc1cccc2cccnc12
Show InChI InChI=1S/C15H11N3O4S/c19-18(20)13-8-1-2-9-14(13)23(21,22)17-12-7-3-5-11-6-4-10-16-15(11)12/h1-10,17H
PDB
MMDB

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n/an/a 3.73E+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 CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2PG1Q6D
More data for this
Ligand-Target Pair
BRCA1-associated RING domain protein 1


(Homo sapiens (Human))
BDBM60287
PNG
(2-nitro-N-(8-quinolinyl)benzenesulfonamide | 2-nit...)
Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)Nc1cccc2cccnc12
Show InChI InChI=1S/C15H11N3O4S/c19-18(20)13-8-1-2-9-14(13)23(21,22)17-12-7-3-5-11-6-4-10-16-15(11)12/h1-10,17H
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n/an/a 4.37E+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 CA...


PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2DZ06SS
More data for this
Ligand-Target Pair
Beta-glucuronidase


(Bos taurus (Bovine))
BDBM60287
PNG
(2-nitro-N-(8-quinolinyl)benzenesulfonamide | 2-nit...)
Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)Nc1cccc2cccnc12
Show InChI InChI=1S/C15H11N3O4S/c19-18(20)13-8-1-2-9-14(13)23(21,22)17-12-7-3-5-11-6-4-10-16-15(11)12/h1-10,17H
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Article
PubMed
n/an/a 1.82E+4n/an/an/an/an/an/a



University of Karachi

Curated by ChEMBL


Assay Description
Antagonistic activity by inhibition histamine H2 receptor from rats.


Eur J Med Chem 139: 849-864 (2017)


Article DOI: 10.1016/j.ejmech.2017.08.052
BindingDB Entry DOI: 10.7270/Q20P12HF
More data for this
Ligand-Target Pair
Nuclear factor NF-kappa-B


(Homo sapiens (Human))
BDBM60287
PNG
(2-nitro-N-(8-quinolinyl)benzenesulfonamide | 2-nit...)
Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)Nc1cccc2cccnc12
Show InChI InChI=1S/C15H11N3O4S/c19-18(20)13-8-1-2-9-14(13)23(21,22)17-12-7-3-5-11-6-4-10-16-15(11)12/h1-10,17H
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n/an/a 3.20E+3n/an/an/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Inhibition of TNF-alpha-stimulated human NF-kappaB p65 RelA subunit nuclear translocation in HUVEC


Bioorg Med Chem Lett 18: 329-35 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.100
BindingDB Entry DOI: 10.7270/Q2348M63
More data for this
Ligand-Target Pair
I-kappa-B-alpha


(Homo sapiens (Human))
BDBM60287
PNG
(2-nitro-N-(8-quinolinyl)benzenesulfonamide | 2-nit...)
Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)Nc1cccc2cccnc12
Show InChI InChI=1S/C15H11N3O4S/c19-18(20)13-8-1-2-9-14(13)23(21,22)17-12-7-3-5-11-6-4-10-16-15(11)12/h1-10,17H
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n/an/an/an/a 1.20E+4n/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Induction of human IkappaBalpha stabilization in OCI-Ly3 cells assessed as ratio of green light emiting IkappaBalpha-fused luciferase expression to r...


Bioorg Med Chem Lett 18: 329-35 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.100
BindingDB Entry DOI: 10.7270/Q2348M63
More data for this
Ligand-Target Pair
I-kappa-B-alpha


(Homo sapiens (Human))
BDBM60287
PNG
(2-nitro-N-(8-quinolinyl)benzenesulfonamide | 2-nit...)
Show SMILES [O-][N+](=O)c1ccccc1S(=O)(=O)Nc1cccc2cccnc12
Show InChI InChI=1S/C15H11N3O4S/c19-18(20)13-8-1-2-9-14(13)23(21,22)17-12-7-3-5-11-6-4-10-16-15(11)12/h1-10,17H
PDB
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n/an/an/an/a 1.10E+4n/an/an/an/a



Columbia University

Curated by ChEMBL


Assay Description
Induction of human IkappaBalpha stabilization in OCI-Ly3 cells by green light emiting IkappaBalpha-fused luciferase reporter gene assay


Bioorg Med Chem Lett 18: 329-35 (2008)


Article DOI: 10.1016/j.bmcl.2007.10.100
BindingDB Entry DOI: 10.7270/Q2348M63
More data for this
Ligand-Target Pair