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Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 522.6
BDBM50084693
Wt: 522.6
BDBM50084704
Wt: 522.6
BDBM50084706

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 3 hits 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 5


(Homo sapiens (Human))
BDBM50084693
PNG
(2-(3-Benzenesulfonylamino-pyrrolidin-1-yl)-N-(6-fl...)
Show SMILES Fc1ccc2C(Cc3cccnc3)C(CCc2c1)NC(=O)CN1CC[C@@H](C1)NS(=O)(=O)c1ccccc1
Show InChI InChI=1S/C28H31FN4O3S/c29-22-9-10-25-21(16-22)8-11-27(26(25)15-20-5-4-13-30-17-20)31-28(34)19-33-14-12-23(18-33)32-37(35,36)24-6-2-1-3-7-24/h1-7,9-10,13,16-17,23,26-27,32H,8,11-12,14-15,18-19H2,(H,31,34)/t23-,26?,27?/m0/s1
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 5n/an/an/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of [125I]-PYY binding to recombinant NPY Y5 receptor on HEK-293 cell membranes.


J Med Chem 43: 346-50 (2000)


BindingDB Entry DOI: 10.7270/Q2XK8DS5
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 5


(Homo sapiens (Human))
BDBM50084704
PNG
(2-(3-Benzenesulfonylamino-pyrrolidin-1-yl)-N-(6-fl...)
Show SMILES Fc1ccc2C(Cc3cccnc3)C(CCc2c1)NC(=O)CN1CCC(C1)NS(=O)(=O)c1ccccc1
Show InChI InChI=1S/C28H31FN4O3S/c29-22-9-10-25-21(16-22)8-11-27(26(25)15-20-5-4-13-30-17-20)31-28(34)19-33-14-12-23(18-33)32-37(35,36)24-6-2-1-3-7-24/h1-7,9-10,13,16-17,23,26-27,32H,8,11-12,14-15,18-19H2,(H,31,34)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

PubMed
n/an/a 11n/an/an/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of [125I]-PYY binding to recombinant NPY Y5 receptor on HEK-293 cell membranes.


J Med Chem 43: 346-50 (2000)


BindingDB Entry DOI: 10.7270/Q2XK8DS5
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 5


(Homo sapiens (Human))
BDBM50084706
PNG
(2-(3-Benzenesulfonylamino-pyrrolidin-1-yl)-N-(6-fl...)
Show SMILES Fc1ccc2C(Cc3cccnc3)C(CCc2c1)NC(=O)CN1CC[C@H](C1)NS(=O)(=O)c1ccccc1
Show InChI InChI=1S/C28H31FN4O3S/c29-22-9-10-25-21(16-22)8-11-27(26(25)15-20-5-4-13-30-17-20)31-28(34)19-33-14-12-23(18-33)32-37(35,36)24-6-2-1-3-7-24/h1-7,9-10,13,16-17,23,26-27,32H,8,11-12,14-15,18-19H2,(H,31,34)/t23-,26?,27?/m1/s1
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 27n/an/an/an/an/an/a



The R. W. Johnson Pharmaceutical Research Institute

Curated by ChEMBL


Assay Description
Inhibition of [125I]-PYY binding to recombinant NPY Y5 receptor on HEK-293 cell membranes.


J Med Chem 43: 346-50 (2000)


BindingDB Entry DOI: 10.7270/Q2XK8DS5
More data for this
Ligand-Target Pair