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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 464.5
BDBM50445664

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))
BDBM50445664
PNG
(CHEMBL3104119)
Show SMILES CCN(CC)C(=O)C(N1CCN(CC1)c1ccc(cc1F)-c1c(C)noc1C)c1ccccc1
Show InChI InChI=1S/C27H33FN4O2/c1-5-30(6-2)27(33)26(21-10-8-7-9-11-21)32-16-14-31(15-17-32)24-13-12-22(18-23(24)28)25-19(3)29-34-20(25)4/h7-13,18,26H,5-6,14-17H2,1-4H3
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 1.00E+4n/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