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Compile Data Set for Download or QSAR

Found 2 hits of ic50 for monomerid = 10452   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Acetylcholinesterase


(Rattus norvegicus (rat))
BDBM10452
PNG
(Bivalent 4-Aminoquinoline 9f | N,N-di-4-Quinolyl-1...)
Show SMILES C(CCCNc1ccnc2ccccc12)CCCNc1ccnc2ccccc12
Show InChI InChI=1S/C25H28N4/c1(2-8-16-26-24-14-18-28-22-12-6-4-10-20(22)24)3-9-17-27-25-15-19-29-23-13-7-5-11-21(23)25/h4-7,10-15,18-19H,1-3,8-9,16-17H2,(H,26,28)(H,27,29)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 87.8n/an/an/an/a7.437



Hong Kong University of Science and Technology



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. Enzyme activity was determined by measuring the absorbance at...


Bioorg Med Chem 7: 2569-75 (1999)


Article DOI: 10.1016/s0968-0896(99)00178-9
BindingDB Entry DOI: 10.7270/Q22N50GZ
More data for this
Ligand-Target Pair
Carboxylic ester hydrolase


(Rattus norvegicus (rat))
BDBM10452
PNG
(Bivalent 4-Aminoquinoline 9f | N,N-di-4-Quinolyl-1...)
Show SMILES C(CCCNc1ccnc2ccccc12)CCCNc1ccnc2ccccc12
Show InChI InChI=1S/C25H28N4/c1(2-8-16-26-24-14-18-28-22-12-6-4-10-20(22)24)3-9-17-27-25-15-19-29-23-13-7-5-11-21(23)25/h4-7,10-15,18-19H,1-3,8-9,16-17H2,(H,26,28)(H,27,29)
Reactome pathway
KEGG

UniProtKB/TrEMBL

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 1.80E+3n/an/an/an/an/an/a



Hong Kong University of Science and Technology



Assay Description
The cholinesterase assays were performed using colorimetric method reported by Ellman. Enzyme activity was determined by measuring the absorbance at...


Bioorg Med Chem 7: 2569-75 (1999)


Article DOI: 10.1016/s0968-0896(99)00178-9
BindingDB Entry DOI: 10.7270/Q22N50GZ
More data for this
Ligand-Target Pair