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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase PAK 4' and Ligand = 'BDBM50449522'   
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
Serine/threonine-protein kinase PAK 4


(Homo sapiens (Human))
BDBM50449522
PNG
(CHEMBL4166424)
Show SMILES OC[C@@H](NC(=O)c1ccc2NC(=O)\C(=C(/c3ncc[nH]3)c3ccc(Cl)c(F)c3)c2c1)c1ccccc1 |r|
Show InChI InChI=1S/C27H20ClFN4O3/c28-19-8-6-16(13-20(19)29)23(25-30-10-11-31-25)24-18-12-17(7-9-21(18)32-27(24)36)26(35)33-22(14-34)15-4-2-1-3-5-15/h1-13,22,34H,14H2,(H,30,31)(H,32,36)(H,33,35)/b24-23-/t22-/m1/s1
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MMDB

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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.29E+3n/an/an/an/an/an/a



Shenyang Pharmaceutical University

Curated by ChEMBL


Assay Description
Inhibition of full length human PAK4 using substrate S2 after 60 mins by HTRF assay


Eur J Med Chem 155: 197-209 (2018)


Article DOI: 10.1016/j.ejmech.2018.05.051
BindingDB Entry DOI: 10.7270/Q2KD21GG
More data for this
Ligand-Target Pair