BDBM50585446 CHEMBL5076629

SMILES O=C1C(CC2CCN(Cc3ccccc3)CC2)Cc2cccc(N3CCN(CCCCc4c[nH]c5ccc(cc45)C#N)CC3)c12

InChI Key InChIKey=OJTNULHHPYTZHP-UHFFFAOYSA-N

Data  2 IC50  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 50585446   

TargetAcetylcholinesterase(Mouse)
East China University of Science and Technology

Curated by ChEMBL
LigandPNGBDBM50585446(CHEMBL5076629)
Affinity DataIC50: 709nMAssay Description:Inhibition of AChE in mouse cortical homogenate using acetylthiocholine iodide as substrate incubated for 20 mins by Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
TargetCholinesterase(Mouse)
East China University of Science and Technology

Curated by ChEMBL
LigandPNGBDBM50585446(CHEMBL5076629)
Affinity DataIC50: 183nMAssay Description:Inhibition of BuChE in mouse serum using butyrylthiocholine iodide as substrate incubated for 20 mins by Ellman's methodMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed
Target5-hydroxytryptamine receptor 1A(Human)
East China University of Science and Technology

Curated by ChEMBL
LigandPNGBDBM50585446(CHEMBL5076629)
Affinity DataEC50:  36nMAssay Description:Agonist activity at human 5-HT1A receptor expressed in HEK293 cells incubated for 60 mins by Eu-cAMP tracer based LANCE ultra cAMP assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
3/7/2023
Entry Details Article
PubMed