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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 311.3
BDBM50264306

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
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
4-hydroxyphenylpyruvate dioxygenase


(Arabidopsis thaliana)
BDBM50264306
PNG
(CHEMBL4071950)
Show SMILES COc1nc2c(C)cccc2cc1C(=O)C1C(=O)CCCC1=O
Show InChI InChI=1S/C18H17NO4/c1-10-5-3-6-11-9-12(18(23-2)19-16(10)11)17(22)15-13(20)7-4-8-14(15)21/h3,5-6,9,15H,4,7-8H2,1-2H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
7n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Inhibition of Arabidopsis thaliana HPPD expressed in Escherichia coli BL21(DE3) using HPPA as substrate after 10 mins by UV-Vis spectrometric analysi...


J Med Chem 60: 4101-4125 (2017)


Article DOI: 10.1021/acs.jmedchem.6b01395
BindingDB Entry DOI: 10.7270/Q2FN18ND
More data for this
Ligand-Target Pair