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BDBM50079013 1-{1-[3-(3-Isopropyl-ureido)-benzyl]-2-oxo-2,3,4,5-tetrahydro-1H-benzo[b]azepin-3-yl}-3-quinolin-6-yl-urea::CHEMBL312841

SMILES: CC(C)NC(=O)Nc1cccc(CN2c3ccccc3CCC(NC(=O)Nc3ccc4ncccc4c3)C2=O)c1

InChI Key: InChIKey=ZGHQNIGNYBQLJU-UHFFFAOYSA-N

Data: 1 KI

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50079013   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Neuropeptide Y receptor type 1


(Homo sapiens (Human))
BDBM50079013
PNG
(1-{1-[3-(3-Isopropyl-ureido)-benzyl]-2-oxo-2,3,4,5...)
Show SMILES CC(C)NC(=O)Nc1cccc(CN2c3ccccc3CCC(NC(=O)Nc3ccc4ncccc4c3)C2=O)c1
Show InChI InChI=1S/C31H32N6O3/c1-20(2)33-30(39)34-24-10-5-7-21(17-24)19-37-28-11-4-3-8-22(28)12-14-27(29(37)38)36-31(40)35-25-13-15-26-23(18-25)9-6-16-32-26/h3-11,13,15-18,20,27H,12,14,19H2,1-2H3,(H2,33,34,39)(H2,35,36,40)
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PC cid
PC sid
UniChem
Article
PubMed
56n/an/an/an/an/an/an/an/a



Shionogi & Company, Ltd.

Curated by ChEMBL


Assay Description
In vitro binding affinity towards Neuropeptide Y receptor type 1 was determined as potency to displace [125I]-peptide YY binding to human neuroblasto...


J Med Chem 42: 2621-32 (1999)


Article DOI: 10.1021/jm990044m
BindingDB Entry DOI: 10.7270/Q2XK8DRQ
More data for this
Ligand-Target Pair