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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 446.6
BDBM50135643

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))
BDBM50135643
PNG
(Benzo[b]thiophene-2-carboxylic acid (2-benzylsulfa...)
Show SMILES CN(C)CCN(C(=O)c1cc2ccccc2s1)c1ccccc1SCc1ccccc1
Show InChI InChI=1S/C26H26N2OS2/c1-27(2)16-17-28(26(29)25-18-21-12-6-8-14-23(21)31-25)22-13-7-9-15-24(22)30-19-20-10-4-3-5-11-20/h3-15,18H,16-17,19H2,1-2H3
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PC cid
PC sid
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Similars

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