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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Transient receptor potential cation channel subfamily V member 1' and Ligand = 'BDBM50253964'   
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
Transient receptor potential cation channel subfamily V member 1


(Rattus norvegicus (rat))
BDBM50253964
PNG
(5-(azetidin-1-yl)-N2-(2,6-dichlorophenyl)-N7-(4-(t...)
Show SMILES FC(F)(F)c1ccc(Nc2nc(nc3sc(Nc4c(Cl)cccc4Cl)nc23)N2CCC2)cc1
Show InChI InChI=1S/C21H15Cl2F3N6S/c22-13-3-1-4-14(23)15(13)28-20-29-16-17(27-12-7-5-11(6-8-12)21(24,25)26)30-19(31-18(16)33-20)32-9-2-10-32/h1,3-8H,2,9-10H2,(H,28,29)(H,27,30,31)
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Article
PubMed
n/an/a 25n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development LLC

Curated by ChEMBL


Assay Description
Antagonist activity at rat TRPV1 expressed in HEK293 cells assessed as inhibition of capsaicin-induced calcium flux


Bioorg Med Chem Lett 19: 40-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.024
BindingDB Entry DOI: 10.7270/Q28052G3
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50253964
PNG
(5-(azetidin-1-yl)-N2-(2,6-dichlorophenyl)-N7-(4-(t...)
Show SMILES FC(F)(F)c1ccc(Nc2nc(nc3sc(Nc4c(Cl)cccc4Cl)nc23)N2CCC2)cc1
Show InChI InChI=1S/C21H15Cl2F3N6S/c22-13-3-1-4-14(23)15(13)28-20-29-16-17(27-12-7-5-11(6-8-12)21(24,25)26)30-19(31-18(16)33-20)32-9-2-10-32/h1,3-8H,2,9-10H2,(H,28,29)(H,27,30,31)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/a 59n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development LLC

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in HEK293 cells assessed as inhibition of capsaicin-induced calcium flux


Bioorg Med Chem Lett 19: 40-6 (2008)


Article DOI: 10.1016/j.bmcl.2008.11.024
BindingDB Entry DOI: 10.7270/Q28052G3
More data for this
Ligand-Target Pair