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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'mitogen-activated protein kinase kinase kinase 3 isoform 1' and Ligand = 'BDBM54961'   
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
mitogen-activated protein kinase kinase kinase 3 isoform 1


(Homo sapiens (Human))
BDBM54961
PNG
(6-(3-ethoxyphenyl)-3-thiophen-2-yl-[1,2,4]triazolo...)
Show SMILES CCOc1cccc(c1)-c1nn2c(nnc2s1)-c1cccs1
Show InChI InChI=1S/C15H12N4OS2/c1-2-20-11-6-3-5-10(9-11)14-18-19-13(12-7-4-8-21-12)16-17-15(19)22-14/h3-9H,2H2,1H3
PDB
MMDB

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PC cid
PC sid
UniChem
Article
PCBioAssay
n/an/an/an/a 1.10E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03MH084830-01 Project Title: TR-FRET HTS Assay for Inhibitors of MEKK2-MEK5 PB1 Domain...


PubChem Bioassay (2009)


Article DOI: 10.1111/cbdd.12174
BindingDB Entry DOI: 10.7270/Q2Q81BH4
More data for this
Ligand-Target Pair