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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Endochitinase A1' and Ligand = 'BDBM81344'   
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
Endochitinase A1


(Neosartorya fumigata (Aspergillus fumigatus))
BDBM81344
PNG
(Argifin-Derived Fragments, 1 | Dimethylguanylurea)
Show SMILES CNC(=O)NC(N)=NC |w:7.7|
Show InChI InChI=1S/C4H10N4O/c1-6-3(5)8-4(9)7-2/h1-2H3,(H4,5,6,7,8,9)
PDB
MMDB

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
MMDB
PC cid
PC sid
UniChem

Patents

MMDB
Article
PubMed
n/an/a 7.90E+4n/an/an/an/a5.537



University of Dundee



Assay Description
Enzyme inhibition assay using chitinase A1 from aspergillus fumigatus.


Chem Biol 17: 1275-81 (2010)


Article DOI: 10.1016/j.chembiol.2010.07.018
BindingDB Entry DOI: 10.7270/Q2JD4V85
More data for this
Ligand-Target Pair
3D
3D Structure (docked)