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BDBM46217 2-(2-dibenzothiophenyloxy)-2-methylpropanoic acid::2-dibenzothiophen-2-yloxy-2-methyl-propanoic acid::2-dibenzothiophen-2-yloxy-2-methyl-propionic acid::2-dibenzothiophen-2-yloxy-2-methylpropanoic acid::MLS-0412044.0001::cid_901652

SMILES: CC(C)(Oc1ccc2sc3ccccc3c2c1)C(O)=O

InChI Key: InChIKey=BIOQSDHKVYJUHX-UHFFFAOYSA-N

Data: 8 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 8 hits for monomerid = 46217   
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
Hematopoietic protein-tyrosine phosphatase (HEPTP)


(Homo sapiens (Human))
BDBM46217
PNG
(2-(2-dibenzothiophenyloxy)-2-methylpropanoic acid ...)
Show SMILES CC(C)(Oc1ccc2sc3ccccc3c2c1)C(O)=O
Show InChI InChI=1S/C16H14O3S/c1-16(2,15(17)18)19-10-7-8-14-12(9-10)11-5-3-4-6-13(11)20-14/h3-9H,1-2H3,(H,17,18)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
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UniChem
PCBioAssay
n/an/a 1.57E+4n/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...


Citation and Details
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM46217
PNG
(2-(2-dibenzothiophenyloxy)-2-methylpropanoic acid ...)
Show SMILES CC(C)(Oc1ccc2sc3ccccc3c2c1)C(O)=O
Show InChI InChI=1S/C16H14O3S/c1-16(2,15(17)18)19-10-7-8-14-12(9-10)11-5-3-4-6-13(11)20-14/h3-9H,1-2H3,(H,17,18)
PDB
MMDB

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n/an/a>9.90E+4n/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...


Citation and Details
More data for this
Ligand-Target Pair
Dual specificity protein phosphatase (VHR)


(Homo sapiens (human))
BDBM46217
PNG
(2-(2-dibenzothiophenyloxy)-2-methylpropanoic acid ...)
Show SMILES CC(C)(Oc1ccc2sc3ccccc3c2c1)C(O)=O
Show InChI InChI=1S/C16H14O3S/c1-16(2,15(17)18)19-10-7-8-14-12(9-10)11-5-3-4-6-13(11)20-14/h3-9H,1-2H3,(H,17,18)
PDB
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n/an/a 3.71E+4n/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...


Citation and Details
More data for this
Ligand-Target Pair
tyrosine-protein phosphatase non-receptor type 12 isoform 2


(Homo sapiens)
BDBM46217
PNG
(2-(2-dibenzothiophenyloxy)-2-methylpropanoic acid ...)
Show SMILES CC(C)(Oc1ccc2sc3ccccc3c2c1)C(O)=O
Show InChI InChI=1S/C16H14O3S/c1-16(2,15(17)18)19-10-7-8-14-12(9-10)11-5-3-4-6-13(11)20-14/h3-9H,1-2H3,(H,17,18)
PDB
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n/an/a 9.45E+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...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 22


(Homo sapiens (Human))
BDBM46217
PNG
(2-(2-dibenzothiophenyloxy)-2-methylpropanoic acid ...)
Show SMILES CC(C)(Oc1ccc2sc3ccccc3c2c1)C(O)=O
Show InChI InChI=1S/C16H14O3S/c1-16(2,15(17)18)19-10-7-8-14-12(9-10)11-5-3-4-6-13(11)20-14/h3-9H,1-2H3,(H,17,18)
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UniChem
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n/an/a 7.75E+4n/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...


Citation and Details
More data for this
Ligand-Target Pair
Tyrosine-protein phosphatase non-receptor type 22


(Homo sapiens (Human))
BDBM46217
PNG
(2-(2-dibenzothiophenyloxy)-2-methylpropanoic acid ...)
Show SMILES CC(C)(Oc1ccc2sc3ccccc3c2c1)C(O)=O
Show InChI InChI=1S/C16H14O3S/c1-16(2,15(17)18)19-10-7-8-14-12(9-10)11-5-3-4-6-13(11)20-14/h3-9H,1-2H3,(H,17,18)
PDB

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antibodypedia
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PC sid
UniChem
PCBioAssay
n/an/a 8.38E+4n/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...


Citation and Details
More data for this
Ligand-Target Pair
Hematopoietic protein-tyrosine phosphatase (HEPTP)


(Homo sapiens (Human))
BDBM46217
PNG
(2-(2-dibenzothiophenyloxy)-2-methylpropanoic acid ...)
Show SMILES CC(C)(Oc1ccc2sc3ccccc3c2c1)C(O)=O
Show InChI InChI=1S/C16H14O3S/c1-16(2,15(17)18)19-10-7-8-14-12(9-10)11-5-3-4-6-13(11)20-14/h3-9H,1-2H3,(H,17,18)
PDB

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UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem
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n/an/a 450n/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...


Citation and Details
More data for this
Ligand-Target Pair
Hematopoietic protein-tyrosine phosphatase (HEPTP)


(Homo sapiens (Human))
BDBM46217
PNG
(2-(2-dibenzothiophenyloxy)-2-methylpropanoic acid ...)
Show SMILES CC(C)(Oc1ccc2sc3ccccc3c2c1)C(O)=O
Show InChI InChI=1S/C16H14O3S/c1-16(2,15(17)18)19-10-7-8-14-12(9-10)11-5-3-4-6-13(11)20-14/h3-9H,1-2H3,(H,17,18)
PDB

KEGG

UniProtKB/SwissProt

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antibodypedia
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 3.02E+4n/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...


Citation and Details
More data for this
Ligand-Target Pair