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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'M-phase inducer phosphatase 2' and Ligand = 'BDBM50057668'   
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
M-phase inducer phosphatase 2


(Homo sapiens (Human))
BDBM50057668
PNG
(CHEMBL3322853)
Show SMILES [O-][N+](=O)c1ccc(Oc2ccc(cc2)-c2nnc(NC(=O)c3ccccc3F)s2)c(c1)[N+]([O-])=O
Show InChI InChI=1S/C21H12FN5O6S/c22-16-4-2-1-3-15(16)19(28)23-21-25-24-20(34-21)12-5-8-14(9-6-12)33-18-10-7-13(26(29)30)11-17(18)27(31)32/h1-11H,(H,23,25,28)
PDB
MMDB

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Similars

Article
PubMed
n/an/a 5.42E+3n/an/an/an/an/an/a



Liaoning Normal University

Curated by ChEMBL


Assay Description
Inhibition of Cdc25B (unknown origin)


Bioorg Med Chem Lett 24: 4125-8 (2014)


Article DOI: 10.1016/j.bmcl.2014.07.055
BindingDB Entry DOI: 10.7270/Q2MP54XR
More data for this
Ligand-Target Pair