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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cholinesterase' and Ligand = 'BDBM50555654'   
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
Cholinesterase


(Equus caballus (Horse))
BDBM50555654
PNG
(CHEMBL4797435)
Show SMILES OCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(Br)cc1
PDB

UniProtKB/SwissProt

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MCE
PC cid
PC sid
UniChem
Article
PubMed
24n/an/an/an/an/an/an/an/a


TBA

Assay Description
Mixed inhibition of equine serum BChE using butyrylthiolcholine iodide as substrate by Lineweaver-Burk plot analysis


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112273
BindingDB Entry DOI: 10.7270/Q2T157BP
More data for this
Ligand-Target Pair
Cholinesterase


(Equus caballus (Horse))
BDBM50555654
PNG
(CHEMBL4797435)
Show SMILES OCCN(Cc1nn(c2OS(=O)(=O)CCc12)-c1ccccc1F)Cc1ccc(Br)cc1
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 7.70n/an/an/an/an/an/a


TBA

Assay Description
Inhibition of equine serum BuChE using butyrylthiocholine iodide as substrate preincubated with enzyme for 20 mins followed by addition of substrate ...


Citation and Details

Article DOI: 10.1016/j.ejmech.2020.112273
BindingDB Entry DOI: 10.7270/Q2T157BP
More data for this
Ligand-Target Pair