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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 = 50297086   
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))
BDBM50297086
PNG
((S)-N-cyclobutyl-2-phenoxy-N-(pyrrolidin-3-yl)benz...)
Show SMILES O=C(N(C1CCC1)[C@H]1CCNC1)c1ccccc1Oc1ccccc1
Show InChI InChI=1/C21H24N2O2/c24-21(23(16-7-6-8-16)17-13-14-22-15-17)19-11-4-5-12-20(19)25-18-9-2-1-3-10-18/h1-5,9-12,16-17,22H,6-8,13-15H2/t17-/s2
PDB

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 3.37E+3n/an/an/an/an/an/a



Pfizer Global Research and Development

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6


Bioorg Med Chem Lett 19: 4579-83 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.096
BindingDB Entry DOI: 10.7270/Q2NV9J96
More data for this
Ligand-Target Pair