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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 1' and Ligand = 'BDBM50351773'   
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 1


(Homo sapiens (Human))
BDBM50351773
PNG
(CHEMBL1823961)
Show SMILES COc1cccc(\C=C\C(=O)NC(Cc2ccc3cc(OCc4ccccc4F)ccc3c2)C(O)=O)c1
Show InChI InChI=1S/C30H26FNO5/c1-36-25-7-4-5-20(16-25)10-14-29(33)32-28(30(34)35)17-21-9-11-23-18-26(13-12-22(23)15-21)37-19-24-6-2-3-8-27(24)31/h2-16,18,28H,17,19H2,1H3,(H,32,33)(H,34,35)/b14-10+
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Similars

Article
PubMed
n/an/a 8.15E+3n/an/an/an/an/an/a



Yanbian University

Curated by ChEMBL


Assay Description
Inhibition of PTP1B using p-nitrophenyl phosphate as substrate


Eur J Med Chem 46: 3630-8 (2011)


Article DOI: 10.1016/j.ejmech.2011.05.027
BindingDB Entry DOI: 10.7270/Q2W09685
More data for this
Ligand-Target Pair