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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Phosphatidylinositol 4-kinase beta' and Ligand = 'BDBM50457887'   
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
Phosphatidylinositol 4-kinase beta


(Homo sapiens (Human))
BDBM50457887
PNG
(CHEMBL4214728)
Show SMILES Nc1nc(N2CCN(CC2)C(=O)Nc2ccc(OC(F)(F)F)cc2)c2ncsc2n1
Show InChI InChI=1S/C17H16F3N7O2S/c18-17(19,20)29-11-3-1-10(2-4-11)23-16(28)27-7-5-26(6-8-27)13-12-14(30-9-22-12)25-15(21)24-13/h1-4,9H,5-8H2,(H,23,28)(H2,21,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 331n/an/an/an/an/an/a



UCB Pharma

Curated by ChEMBL


Assay Description
Inhibition of PI4K3beta in human PBMC assessed as reduction in mitomycin-C treated human RPMI1788 cells-stimulated lymphocyte proliferation by measur...


J Med Chem 61: 6705-6723 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00521
BindingDB Entry DOI: 10.7270/Q2FF3W01
More data for this
Ligand-Target Pair
Phosphatidylinositol 4-kinase beta


(Homo sapiens (Human))
BDBM50457887
PNG
(CHEMBL4214728)
Show SMILES Nc1nc(N2CCN(CC2)C(=O)Nc2ccc(OC(F)(F)F)cc2)c2ncsc2n1
Show InChI InChI=1S/C17H16F3N7O2S/c18-17(19,20)29-11-3-1-10(2-4-11)23-16(28)27-7-5-26(6-8-27)13-12-14(30-9-22-12)25-15(21)24-13/h1-4,9H,5-8H2,(H,23,28)(H2,21,24,25)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 548n/an/an/an/an/an/a



UCB Pharma

Curated by ChEMBL


Assay Description
Inhibition of recombinant human full length GST-tagged PI4K3beta expressed in baculovirus expression system using PI lipid kinase substrate after 60 ...


J Med Chem 61: 6705-6723 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00521
BindingDB Entry DOI: 10.7270/Q2FF3W01
More data for this
Ligand-Target Pair