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BDBM50537057 CHEMBL4551611

SMILES: Oc1ccccc1NS(=O)(=O)c1cccc(c1)[N+]([O-])=O

InChI Key: InChIKey=FEFUMBFOUOVWMC-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 50537057   
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
ATP-dependent RNA helicase DDX1


(Homo sapiens (Human))
BDBM50537057
PNG
(CHEMBL4551611)
Show SMILES Oc1ccccc1NS(=O)(=O)c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C12H10N2O5S/c15-12-7-2-1-6-11(12)13-20(18,19)10-5-3-4-9(8-10)14(16)17/h1-8,13,15H
PDB

KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human DDX1 helicase activity


J Med Chem 62: 2333-2347 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01403
More data for this
Ligand-Target Pair
ATP-dependent RNA helicase DDX3X


(Homo sapiens (Human))
BDBM50537057
PNG
(CHEMBL4551611)
Show SMILES Oc1ccccc1NS(=O)(=O)c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C12H10N2O5S/c15-12-7-2-1-6-11(12)13-20(18,19)10-5-3-4-9(8-10)14(16)17/h1-8,13,15H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem
Article
PubMed
n/an/a>2.00E+5n/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of human DDX3X ATPase activity using DDX3 as substrate by ADP-Glo kinase assay


J Med Chem 62: 2333-2347 (2019)


Article DOI: 10.1021/acs.jmedchem.8b01403
More data for this
Ligand-Target Pair