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Compile Data Set for Download or QSAR

Found 2 hits of kd data for polymerid = 1043   
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
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50020522
PNG
(1-(((4-carbamoylpyridinium-1-yl)methoxy)methyl)-2-...)
Show SMILES NC(=O)c1cc[n+](COC[n+]2ccccc2CN=O)cc1
Show InChI InChI=1S/C14H15N4O3/c15-14(19)12-4-7-17(8-5-12)10-21-11-18-6-2-1-3-13(18)9-16-20/h1-8H,9-11H2,(H-,15,19)/q+1/p+1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/a 2.40E+4n/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Binding affinity to AChE in rat brain homogenate


J Med Chem 54: 3319-30 (2011)


Article DOI: 10.1021/jm200054r
BindingDB Entry DOI: 10.7270/Q25D8S9W
More data for this
Ligand-Target Pair
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM50011780
PNG
(2-[(E)-(hydroxyimino)methyl]-1-methylpyridinium ch...)
Show SMILES C[n+]1ccccc1CN=O
Show InChI InChI=1S/C7H9N2O/c1-9-5-3-2-4-7(9)6-8-10/h2-5H,6H2,1H3/q+1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/a 2.10E+5n/an/an/an/an/a



Human BioMolecular Research Institute

Curated by ChEMBL


Assay Description
Binding affinity to AChE in rat brain homogenate


J Med Chem 54: 3319-30 (2011)


Article DOI: 10.1021/jm200054r
BindingDB Entry DOI: 10.7270/Q25D8S9W
More data for this
Ligand-Target Pair