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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Cytochrome P450 2D6' and Monomerid = 50203941   
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
Cytochrome P450 2D6 (2D6)


(Homo sapiens (Human))
BDBM50203941
PNG
((S)-pyrrolidin-3-yl-(tetrahydro-pyran-4-yl)-(2-tri...)
Show SMILES FC(F)(F)c1ccccc1CN([C@H]1CCNC1)C1CCOCC1
Show InChI InChI=1S/C17H23F3N2O/c18-17(19,20)16-4-2-1-3-13(16)12-22(15-5-8-21-11-15)14-6-9-23-10-7-14/h1-4,14-15,21H,5-12H2/t15-/m0/s1
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 3.00E+4n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human CYP2D6


Bioorg Med Chem Lett 17: 2022-5 (2007)


Article DOI: 10.1016/j.bmcl.2007.01.020
BindingDB Entry DOI: 10.7270/Q20R9P2S
More data for this
Ligand-Target Pair