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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 493.6
BDBM50445656

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))
BDBM50445656
PNG
(CHEMBL3104227)
Show SMILES CCC(CC)C(=O)Nc1ccc(N2CCN(CC2)C(c2nc(no2)C(C)C)c2ccccc2)c(F)c1
Show InChI InChI=1S/C28H36FN5O2/c1-5-20(6-2)27(35)30-22-12-13-24(23(29)18-22)33-14-16-34(17-15-33)25(21-10-8-7-9-11-21)28-31-26(19(3)4)32-36-28/h7-13,18-20,25H,5-6,14-17H2,1-4H3,(H,30,35)
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Similars

Article
PubMed
n/an/a 170n/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