BDBM50096250 CHEMBL3593658

SMILES COCCN(CC1CCCN(C1)C1Cc2ccccc2C1)C(=O)c1cc([N+]([O-])=O)c2cccnc2c1O

InChI Key InChIKey=JMMPUTVKLCAIID-CKTMTVGTSA-N

Data  1 IC50

PDB links: 1 PDB ID matches this monomer.

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50096250   

TargetCholinesterase(Homo sapiens (Human))
University Of Ljubljana

Curated by ChEMBL

LigandBDBM50096250(CHEMBL3593658)Copy SMILESCopy InChI

Affinity DataIC50:  215nMAssay Description:Inhibition of human recombinant BChE using butyrylthiocholine iodide as substrate after 5 mins by Ellman's methodMore data for this Ligand-Target Pair

Target InfoPDBMMDBReactome pathwayKEGG
UniProtKB/SwissProt
B.MOADDrugBankantibodypediaGoogleScholar

Ligand InfoCHEMBLPC cidPC sidPDBPatentsSimilars

In DepthDetails ArticlePubMedPDB3D Structure (crystal)
Copy BDB DOI