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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Hematopoietic protein-tyrosine phosphatase (HEPTP)' and Ligand = 'BDBM31735'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/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))
BDBM31735
PNG
((7Z)-3-bromanyl-7-(furan-2-ylmethylidene)-[1,3]thi...)
Show SMILES Brc1cnc2c(c1)nc1s\c(=C/c3ccco3)c(=O)n21
Show InChI InChI=1S/C13H6BrN3O2S/c14-7-4-9-11(15-6-7)17-12(18)10(20-13(17)16-9)5-8-2-1-3-19-8/h1-6H/b10-5-
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 127n/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)

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


(Homo sapiens (Human))
BDBM31735
PNG
((7Z)-3-bromanyl-7-(furan-2-ylmethylidene)-[1,3]thi...)
Show SMILES Brc1cnc2c(c1)nc1s\c(=C/c3ccco3)c(=O)n21
Show InChI InChI=1S/C13H6BrN3O2S/c14-7-4-9-11(15-6-7)17-12(18)10(20-13(17)16-9)5-8-2-1-3-19-8/h1-6H/b10-5-
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 949n/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)

More data for this
Ligand-Target Pair