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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 432.6
BDBM50135647

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))
BDBM50135647
PNG
(CHEMBL328861 | N-(2-Benzylsulfanyl-phenyl)-N-(3-di...)
Show SMILES CC(C(=O)N(CCCN(C)C)c1ccccc1SCc1ccccc1)c1ccccc1
Show InChI InChI=1S/C27H32N2OS/c1-22(24-15-8-5-9-16-24)27(30)29(20-12-19-28(2)3)25-17-10-11-18-26(25)31-21-23-13-6-4-7-14-23/h4-11,13-18,22H,12,19-21H2,1-3H3
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PC cid
PC sid
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n/an/a 1.00E+3n/an/an/an/an/an/a



Bristol-Myers Squibb Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Binding affinity against SMS-KAN cell membranes endogenously expressing Neuropeptide Y receptor type 2 using [125I]-PYY as radioligand


Bioorg Med Chem Lett 13: 2883-5 (2003)


BindingDB Entry DOI: 10.7270/Q2F47NJQ
More data for this
Ligand-Target Pair