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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'tyrosine-protein phosphatase non-receptor type 12 isoform 2' and Ligand = 'BDBM48802'   
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
tyrosine-protein phosphatase non-receptor type 12 isoform 2


(Homo sapiens (Human))
BDBM48802
PNG
(2-[2-ethoxy-4-[[[4-[2-(4-methylanilino)-1,3-thiazo...)
Show SMILES CCOc1cc(C=NNC(=O)c2ccc(cc2)-c2csc(Nc3ccc(C)cc3)n2)ccc1OCC(O)=O |w:7.7|
Show InChI InChI=1S/C28H26N4O5S/c1-3-36-25-14-19(6-13-24(25)37-16-26(33)34)15-29-32-27(35)21-9-7-20(8-10-21)23-17-38-28(31-23)30-22-11-4-18(2)5-12-22/h4-15,17H,3,16H2,1-2H3,(H,30,31)(H,32,35)(H,33,34)
PDB
MMDB

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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.00E+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 (2010)


BindingDB Entry DOI: 10.7270/Q28G8J5T
More data for this
Ligand-Target Pair