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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Serine/threonine-protein kinase TBK1' and Ligand = 'BDBM50469233'   
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 TBK1


(Homo sapiens (Human))
BDBM50469233
PNG
(CHEMBL4292344)
Show SMILES CC(=C)c1cc2c(cc1F)oc1nc(N)c(cc1c2=O)C(O)=O
Show InChI InChI=1S/C16H11FN2O4/c1-6(2)7-3-8-12(5-11(7)17)23-15-9(13(8)20)4-10(16(21)22)14(18)19-15/h3-5H,1H2,2H3,(H2,18,19)(H,21,22)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 790n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibition of human TBK1 (1 to 657 residues) expressed in Baculovirus infected SF9 insect cells using myelin basic protein as substrate in presence o...


Bioorg Med Chem 26: 5443-5461 (2018)


Article DOI: 10.1016/j.bmc.2018.09.020
BindingDB Entry DOI: 10.7270/Q2M04858
More data for this
Ligand-Target Pair
Serine/threonine-protein kinase TBK1


(Homo sapiens (Human))
BDBM50469233
PNG
(CHEMBL4292344)
Show SMILES CC(=C)c1cc2c(cc1F)oc1nc(N)c(cc1c2=O)C(O)=O
Show InChI InChI=1S/C16H11FN2O4/c1-6(2)7-3-8-12(5-11(7)17)23-15-9(13(8)20)4-10(16(21)22)14(18)19-15/h3-5H,1H2,2H3,(H2,18,19)(H,21,22)
PDB

KEGG

UniProtKB/SwissProt

B.MOAD
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 794n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibition of human TBK1 (1 to 657 residues) expressed in Baculovirus infected SF9 insect cells using myelin basic protein as substrate in presence o...


Bioorg Med Chem 26: 5443-5461 (2018)


Article DOI: 10.1016/j.bmc.2018.09.020
BindingDB Entry DOI: 10.7270/Q2M04858
More data for this
Ligand-Target Pair