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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with all data for assayid = 6 entry = 50047554   
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))		BDBM50174562
PNG
(CHEMBL3809320)
Show SMILES COc1ccc(\C=C2\S\C(NC2=O)=N/c2nc3cc(sc3s2)-c2ccc(Cl)cc2)cc1
Show InChI InChI=1S/C22H14ClN3O2S3/c1-28-15-8-2-12(3-9-15)10-18-19(27)25-22(30-18)26-21-24-16-11-17(29-20(16)31-21)13-4-6-14(23)7-5-13/h2-11H,1H3,(H,24,25,26,27)/b18-10+
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Similars
Article
PubMed
 3.71E+4n/an/an/an/an/an/an/an/a



Universit£ de Lorraine

Curated by ChEMBL


Assay Description
Mixed type inhibition of human recombinant full length GST-tagged CDC25A transfected in Escherichia coli BL21-DE3 assessed as enzyme/inhibitor comple...

Bioorg Med Chem 24: 2920-2928 (2016)


Article DOI: 10.1016/j.bmc.2016.04.063
BindingDB Entry DOI: 10.7270/Q22J6DS9
More data for this
Ligand-Target Pair