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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Pantothenate kinase 1' and Ligand = 'BDBM50071449'   
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
Pantothenate kinase 1


(Homo sapiens (Human))
BDBM50071449
PNG
(CHEMBL3410398)
Show SMILES Cc1nc2c3cccnc3nn2c(C)c1CCC(=O)Nc1cccc(c1)C(F)(F)F
Show InChI InChI=1S/C21H18F3N5O/c1-12-16(13(2)29-20(26-12)17-7-4-10-25-19(17)28-29)8-9-18(30)27-15-6-3-5-14(11-15)21(22,23)24/h3-7,10-11H,8-9H2,1-2H3,(H,27,30)
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 190n/an/an/an/an/an/a



St. Jude Children's Research Hospital

Curated by ChEMBL


Assay Description
Inhibition of Pank1beta (unknown origin) by Kinase Glo HTS assay


J Med Chem 58: 1563-8 (2015)


Article DOI: 10.1021/jm501585q
More data for this
Ligand-Target Pair