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BDBM20340 1-isoquinolin-5-yl-3-{[4-(4-methylpiperidin-1-yl)phenyl]methyl}urea::Isoquinoline Analogue, 34

SMILES: CC1CCN(CC1)c1ccc(CNC(=O)Nc2cccc3cnccc23)cc1

InChI Key: InChIKey=MNYKWMUXKZDDBQ-UHFFFAOYSA-N

Data: 1 EC50

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

Found 1 hit for monomerid = 20340   
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
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM20340
PNG
(1-isoquinolin-5-yl-3-{[4-(4-methylpiperidin-1-yl)p...)
Show SMILES CC1CCN(CC1)c1ccc(CNC(=O)Nc2cccc3cnccc23)cc1
Show InChI InChI=1S/C23H26N4O/c1-17-10-13-27(14-11-17)20-7-5-18(6-8-20)15-25-23(28)26-22-4-2-3-19-16-24-12-9-21(19)22/h2-9,12,16-17H,10-11,13-15H2,1H3,(H2,25,26,28)
PDB
MMDB

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PC cid
PC sid
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Similars

Article
PubMed
n/an/an/an/a 9.30n/an/a7.422



Abbott Laboratories



Assay Description
The functional antagonist activity of compounds at the TRPV1 receptor was determined with a Ca2+ influx assay by measuring the effect on capsaicin (0...


J Med Chem 50: 3651-60 (2007)


Article DOI: 10.1021/jm070276i
BindingDB Entry DOI: 10.7270/Q2SJ1HWH
More data for this
Ligand-Target Pair