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Compile Data Set for Download or QSAR
Found
2
Enz. Inhib. hit(s) with Target = 'Acetylcholinesterase' and Ligand = 'BDBM50027342'
Target
Acetylcholinesterase
(Bos taurus (bovine))
Universit£ di Siena
Curated by
ChEMBL
Ligand
BDBM50027342
(CHEMBL483105)
Show SMILES
CCOP(C)(=O)SCCN(C(C)C)C(C)C
Show InChI
InChI=1S/C11H26NO2PS/c1-7-14-15(6,13)16-9-8-12(10(2)3)11(4)5/h10-11H,7-9H2,1-6H3
Affinity Data
K
off
: 1.10E+5s
-1
Assay Description:
Inhibition of bovine AChE
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
GoogleScholar
Ligand Info
Purchase
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed
Target
Acetylcholinesterase
(Homo sapiens (Human))
Universit£ di Siena
Curated by
ChEMBL
Ligand
BDBM50027342
(CHEMBL483105)
Show SMILES
CCOP(C)(=O)SCCN(C(C)C)C(C)C
Show InChI
InChI=1S/C11H26NO2PS/c1-7-14-15(6,13)16-9-8-12(10(2)3)11(4)5/h10-11H,7-9H2,1-6H3
Affinity Data
K
off
: 2.00E+6s
-1
Assay Description:
Inhibition of human AChE
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
NCI pathway
Reactome pathway
KEGG
UniProtKB/SwissProt
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
Purchase
CHEMBL
PC cid
PC sid
Similars
In Depth
Details
Article
PubMed