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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Vanilloid receptor' and Ligand = 'BDBM50082238'   
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
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50082238
PNG
(Acetic acid 2-benzyl-3-[2-(4-hydroxy-3-methoxy-phe...)
Show SMILES COc1cc(CC(=O)NCC(COC(C)=O)Cc2ccccc2)ccc1O
Show InChI InChI=1S/C21H25NO5/c1-15(23)27-14-18(10-16-6-4-3-5-7-16)13-22-21(25)12-17-8-9-19(24)20(11-17)26-2/h3-9,11,18,24H,10,12-14H2,1-2H3,(H,22,25)
PDB
MMDB

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PC cid
PC sid
UniChem
PubMed
1.93E+4n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
In vitro binding affinity towards vanilloid receptor by [3H]RTX displacement.


Bioorg Med Chem Lett 9: 2909-14 (1999)


BindingDB Entry DOI: 10.7270/Q2HT2PTB
More data for this
Ligand-Target Pair