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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 209.2
BDBM50023170

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Phenylethanolamine N-methyltransferase


(Bos taurus (bovine))
BDBM50023170
PNG
(1-(9H-Fluoren-1-yl)-ethylamine | CHEMBL350036)
Show SMILES CC(N)c1cccc-2c1Cc1ccccc-21
Show InChI InChI=1S/C15H15N/c1-10(16)12-7-4-8-14-13-6-3-2-5-11(13)9-15(12)14/h2-8,10H,9,16H2,1H3
PDB

UniProtKB/SwissProt

GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
4.14E+3n/an/an/an/an/an/an/an/a



University of Kansas

Curated by ChEMBL


Assay Description
In vitro inhibition of compound towards phenylethanolamine N-methyltransferase(PNMT) isolated from bovine adrenal glands


J Med Chem 31: 60-5 (1988)


BindingDB Entry DOI: 10.7270/Q2QC02HG
More data for this
Ligand-Target Pair