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Compile Data Set for Download or QSAR
maximum 50k data
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
2
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Target
Acetylcholinesterase
(Rattus norvegicus (rat))
Shanghai Institute Of Materia Medica
Ligand
BDBM8982
(N-[2-(1-benzylpiperidin-4-yl)ethyl]-2-(2,3-dihydro...)
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Affinity Data
IC50: 230nM
pH: 8.0 T: 2°C
Assay Description:
The cholinesterase assays were performed using colorimetric method reported by Ellman. The appearance of product was monitored at 412 nm for 5 min us...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
Article
PubMed
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Target
Carboxylic ester hydrolase
(Rattus norvegicus (rat))
Shanghai Institute Of Materia Medica
Ligand
BDBM8982
(N-[2-(1-benzylpiperidin-4-yl)ethyl]-2-(2,3-dihydro...)
Copy SMILES
Copy InChI
Affinity Data
IC50: 6.92E+3nM
pH: 8.0 T: 2°C
Assay Description:
The cholinesterase assays were performed using colorimetric method reported by Ellman. The appearance of product was monitored at 412 nm for 5 min us...
More data for this Ligand-Target Pair
Target Info
Reactome pathway
KEGG
UniProtKB/TrEMBL
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
Article
PubMed
Copy BDB DOI