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BDBM32853 (1,3-dioxoisoindol-2-yl) 2,4-dimethylbenzenesulfonate::2,4-dimethylbenzenesulfonic acid (1,3-dioxo-2-isoindolyl) ester::2,4-dimethylbenzenesulfonic acid phthalimido ester::2-{[(2,4-dimethylphenyl)sulfonyl]oxy}-1H-isoindole-1,3(2H)-dione::MLS000579570::SMR000199007::[1,3-bis(oxidanylidene)isoindol-2-yl] 2,4-dimethylbenzenesulfonate::cid_2196572

SMILES: Cc1ccc(c(C)c1)S(=O)(=O)ON1C(=O)c2ccccc2C1=O

InChI Key: InChIKey=CFYUCVMWWSCWHI-UHFFFAOYSA-N

Data: 4 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 6 hits for monomerid = 32853   
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
Prothrombin


(Homo sapiens (Human))
BDBM32853
PNG
((1,3-dioxoisoindol-2-yl) 2,4-dimethylbenzenesulfon...)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)ON1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C16H13NO5S/c1-10-7-8-14(11(2)9-10)23(20,21)22-17-15(18)12-5-3-4-6-13(12)16(17)19/h3-9H,1-2H3
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PCBioAssay
n/an/a 856n/an/an/an/a7.523



PCMD

Curated by PubChem BioAssay


Assay Description
HTS was performed using 217,350 compounds of the MLSCN library individually plated into 10ul 1536 compound plates at a concentration of 2.5 mM each, ...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2K64GDN
More data for this
Ligand-Target Pair
Coagulation factor XI


(Homo sapiens (Human))
BDBM32853
PNG
((1,3-dioxoisoindol-2-yl) 2,4-dimethylbenzenesulfon...)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)ON1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C16H13NO5S/c1-10-7-8-14(11(2)9-10)23(20,21)22-17-15(18)12-5-3-4-6-13(12)16(17)19/h3-9H,1-2H3
PDB
MMDB

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KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
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PCBioAssay
n/an/a 1.08E+3n/an/an/an/a7.423



PCMD

Curated by PubChem BioAssay


Assay Description
Factor XIa (0.23 ug/mL) was incubated with Boc-Glu-Ala-Arg-AMC substrate (15 uM) in 10 uL of assay buffer for 2 hr at room temperature. Read fluoresc...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2H993J6
More data for this
Ligand-Target Pair
Endothelial PAS domain-containing protein 1


(Homo sapiens (Human))
BDBM32853
PNG
((1,3-dioxoisoindol-2-yl) 2,4-dimethylbenzenesulfon...)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)ON1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C16H13NO5S/c1-10-7-8-14(11(2)9-10)23(20,21)22-17-15(18)12-5-3-4-6-13(12)16(17)19/h3-9H,1-2H3
PDB
MMDB

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KEGG

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n/an/a 5.62E+3n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2WS8RVZ
More data for this
Ligand-Target Pair
60S ribosomal protein L19-A


(Saccharomyces cerevisiae)
BDBM32853
PNG
((1,3-dioxoisoindol-2-yl) 2,4-dimethylbenzenesulfon...)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)ON1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C16H13NO5S/c1-10-7-8-14(11(2)9-10)23(20,21)22-17-15(18)12-5-3-4-6-13(12)16(17)19/h3-9H,1-2H3
PDB
MMDB

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KEGG

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PCBioAssay
n/an/an/an/a 1.40E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2JQ0ZGP
More data for this
Ligand-Target Pair
Vacuolar aminopeptidase 1


(Saccharomyces cerevisiae)
BDBM32853
PNG
((1,3-dioxoisoindol-2-yl) 2,4-dimethylbenzenesulfon...)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)ON1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C16H13NO5S/c1-10-7-8-14(11(2)9-10)23(20,21)22-17-15(18)12-5-3-4-6-13(12)16(17)19/h3-9H,1-2H3
PDB

KEGG

UniProtKB/SwissProt

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PC cid
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PCBioAssay
n/an/an/an/a 3.89E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q21R6P02
More data for this
Ligand-Target Pair
Coagulation factor XII


(Homo sapiens (Human))
BDBM32853
PNG
((1,3-dioxoisoindol-2-yl) 2,4-dimethylbenzenesulfon...)
Show SMILES Cc1ccc(c(C)c1)S(=O)(=O)ON1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C16H13NO5S/c1-10-7-8-14(11(2)9-10)23(20,21)22-17-15(18)12-5-3-4-6-13(12)16(17)19/h3-9H,1-2H3
PDB

UniProtKB/SwissProt

antibodypedia
GoogleScholar
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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 8.48E+3n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q21G0JQS
More data for this
Ligand-Target Pair