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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'M-phase inducer phosphatase 1' and Ligand = 'BDBM50388825'   
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 1


(Homo sapiens (Human))
BDBM50388825
PNG
(CHEMBL2062595)
Show SMILES CCCCCCCCCCCCCCCC(NCc1cccc(OC)c1)=C1C(=O)OC(CO)C1=O |w:15.15|
Show InChI InChI=1S/C29H45NO5/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-19-25(27-28(32)26(22-31)35-29(27)33)30-21-23-17-16-18-24(20-23)34-2/h16-18,20,26,30-31H,3-15,19,21-22H2,1-2H3
PDB
MMDB

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Similars

Article
PubMed
n/an/a 1.02E+4n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Inhibition of CDC25A


ACS Med Chem Lett 3: 294-298 (2012)


Article DOI: 10.1021/ml2002778
BindingDB Entry DOI: 10.7270/Q2ZW1N0H
More data for this
Ligand-Target Pair