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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'M-phase inducer phosphatase 3' and Ligand = 'BDBM50155602'   
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 3


(Homo sapiens (Human))
BDBM50155602
PNG
(CHEMBL359780 | [3-Methoxy-4-({methyl-[2-(4-nitro-p...)
Show SMILES COc1cc(ccc1CN(C)CCc1ccc(cc1)[N+]([O-])=O)N(C)C
Show InChI InChI=1S/C19H25N3O3/c1-20(2)18-10-7-16(19(13-18)25-4)14-21(3)12-11-15-5-8-17(9-6-15)22(23)24/h5-10,13H,11-12,14H2,1-4H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a>8.00E+4n/an/an/an/an/an/a



Institut Henri Beaufour

Curated by ChEMBL


Assay Description
Inhibitory concentration for human cell division cycle 25 degree C phosphatase; not active


Bioorg Med Chem Lett 14: 5809-12 (2004)


Article DOI: 10.1016/j.bmcl.2004.09.041
BindingDB Entry DOI: 10.7270/Q2H41S67
More data for this
Ligand-Target Pair