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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 465.5
BDBM50445658

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
Neuropeptide Y receptor type 2


(Homo sapiens (Human))
BDBM50445658
PNG
(CHEMBL3104124)
Show SMILES CCC(CC)C(=O)Nc1ccc(N2CCN(CC2)C(c2nc(C)no2)c2ccccc2)c(F)c1
Show InChI InChI=1S/C26H32FN5O2/c1-4-19(5-2)25(33)29-21-11-12-23(22(27)17-21)31-13-15-32(16-14-31)24(20-9-7-6-8-10-20)26-28-18(3)30-34-26/h6-12,17,19,24H,4-5,13-16H2,1-3H3,(H,29,33)
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Article
PubMed
n/an/a 27n/an/an/an/an/an/a



The Scripps Research Institute

Curated by ChEMBL


Assay Description
Displacement of [125I]-PYY from human NPYY2 receptor


Bioorg Med Chem Lett 24: 430-41 (2014)


Article DOI: 10.1016/j.bmcl.2013.11.061
BindingDB Entry DOI: 10.7270/Q2H133HQ
More data for this
Ligand-Target Pair