BDBM50624581 CHEMBL5396142

SMILES O=c1cc(OCCCNC2CCN(Cc3ccccc3)CC2)c2ccc(cc2o1)-c1cccnc1

InChI Key InChIKey=XDBAVOMSRFQENP-UHFFFAOYSA-N

Data  1 KI  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50624581   

TargetBeta-secretase 1(Human)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50624581(CHEMBL5396142)
Affinity DataIC50: 1.23E+3nMAssay Description:Inhibition of recombinant human BACE1 using fluorogenic polypeptide Mca-SEVNLDAEFRK(Dpn)RRNH2 as substrate incubated for 60 mins by FRET assayMore data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
12/17/2024
Entry Details
PubMed
TargetAcetylcholinesterase(Electric eel)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50624581(CHEMBL5396142)
Affinity DataIC50: 1.31E+3nMAssay Description:Inhibition of electric eel AChE using acetylthiocholine iodine as substrate preincubated for 20 mins followed by substrate addition and measured afte...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
12/17/2024
Entry Details
PubMed
TargetAcetylcholinesterase(Electric eel)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50624581(CHEMBL5396142)
Affinity DataKi:  2.64E+3nMAssay Description:Competitive inhibition of electric eel AChE assessed as dissociation constant using acetylthiocholine as substrate by Lineweaver-Burk plot analysisMore data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
12/17/2024
Entry Details
PubMed
TargetCholinesterase(Horse)
Shenyang Pharmaceutical University

Curated by ChEMBL
LigandPNGBDBM50624581(CHEMBL5396142)
Affinity DataIC50: 3.23E+4nMAssay Description:Inhibition of equine serum BuChE using butylthiocholine iodine as substrate preincubated for 20 mins followed by substrate addition and measured afte...More data for this Ligand-Target Pair
Ligand InfoSimilars
In Depth
Date in BDB:
12/17/2024
Entry Details
PubMed