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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 = 50324116   
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))
BDBM50324116
PNG
((R)-Methyl 2-((1H-Tetrazol-1-yl)methyl)-4-(2-chlor...)
Show SMILES COC(=O)C1=C(Cn2cnnn2)N=C(C)C(C#N)[C@H]1c1ccc(F)cc1Cl
Show InChI InChI=1S/C17H14ClFN6O2/c1-9-12(6-20)15(11-4-3-10(19)5-13(11)18)16(17(26)27-2)14(22-9)7-25-8-21-23-24-25/h3-5,8,12,15H,7H2,1-2H3/t12?,15-/m1/s1
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Similars

Article
PubMed
n/an/a>1.00E+4n/an/an/an/an/an/a



Pfizer Inc

Curated by ChEMBL


Assay Description
Inhibition of CYP2D6


J Med Chem 53: 5970-8 (2010)


Article DOI: 10.1021/jm100506y
BindingDB Entry DOI: 10.7270/Q2XW4KST
More data for this
Ligand-Target Pair