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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Trypanothione reductase' AND taxid = 5671   
Target
(Institution)
LigandTarget
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
Trypanothione reductase


(Leishmania infantum)
BDBM50363766
PNG
(CHEMBL242165)
Show SMILES [O-][N+](=O)c1ccc(\C=C\c2sc(Nc3ccccc3)n[n+]2-c2ccccc2)cc1
Show InChI InChI=1S/C22H17N4O2S/c27-26(28)20-14-11-17(12-15-20)13-16-21-25(19-9-5-2-6-10-19)24-22(29-21)23-18-7-3-1-4-8-18/h1-16H,(H,23,24)/q+1/b16-13+
PDB
MMDB

KEGG

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

AffyNet 
Article
PubMed
n/an/a 1.63E+3n/an/an/an/an/an/a



Instituto Oswaldo Cruz

Curated by ChEMBL


Assay Description
Non-competitive inhibition of recombinant Leishmania infantum MHOM/MA67ITMAP263 trypanothione reductase assessed as inhibition of NADPH consumption u...


Citation and Details
More data for this
Ligand-Target Pair