BindingDB logo
myBDB logout
Compile Data Set for Download or QSAR

Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 421.4
BDBM50101559

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))
BDBM50101559
PNG
(1-(2-Hydroxy-1-methyl-2-phenyl-ethyl)-1-methyl-3-[...)
Show SMILES C[C@H]([C@@H](O)c1ccccc1)N(C)C(=O)Nc1ccc(Oc2cccc(c2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C23H23N3O5/c1-16(22(27)17-7-4-3-5-8-17)25(2)23(28)24-18-11-13-20(14-12-18)31-21-10-6-9-19(15-21)26(29)30/h3-16,22,27H,1-2H3,(H,24,28)/t16-,22-/m1/s1
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
n/an/a 4n/an/an/an/an/an/a



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity tested against Human Neuropeptide Y5 Receptor.


J Med Chem 44: 2344-56 (2001)


BindingDB Entry DOI: 10.7270/Q2DV1J56
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 2


(Homo sapiens (Human))
BDBM50101559
PNG
(1-(2-Hydroxy-1-methyl-2-phenyl-ethyl)-1-methyl-3-[...)
Show SMILES C[C@H]([C@@H](O)c1ccccc1)N(C)C(=O)Nc1ccc(Oc2cccc(c2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C23H23N3O5/c1-16(22(27)17-7-4-3-5-8-17)25(2)23(28)24-18-11-13-20(14-12-18)31-21-10-6-9-19(15-21)26(29)30/h3-16,22,27H,1-2H3,(H,24,28)/t16-,22-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity tested against Human Neuropeptide Y2 Receptor.


J Med Chem 44: 2344-56 (2001)


BindingDB Entry DOI: 10.7270/Q2DV1J56
More data for this
Ligand-Target Pair
Neuropeptide Y receptor type 1


(Homo sapiens (Human))
BDBM50101559
PNG
(1-(2-Hydroxy-1-methyl-2-phenyl-ethyl)-1-methyl-3-[...)
Show SMILES C[C@H]([C@@H](O)c1ccccc1)N(C)C(=O)Nc1ccc(Oc2cccc(c2)[N+]([O-])=O)cc1
Show InChI InChI=1S/C23H23N3O5/c1-16(22(27)17-7-4-3-5-8-17)25(2)23(28)24-18-11-13-20(14-12-18)31-21-10-6-9-19(15-21)26(29)30/h3-16,22,27H,1-2H3,(H,24,28)/t16-,22-/m1/s1
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

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



Amgen Inc.

Curated by ChEMBL


Assay Description
Inhibitory activity tested against Human Neuropeptide Y1 Receptor.


J Med Chem 44: 2344-56 (2001)


BindingDB Entry DOI: 10.7270/Q2DV1J56
More data for this
Ligand-Target Pair