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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 = 'BDBM50150054'   
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


(Homo sapiens (Human))
BDBM50150054
PNG
(CHEMBL3770685)
Show SMILES CC(C(=O)NCc1ccc(nc1N(Cc1ccc(C)cc1)S(=O)(=O)c1ccc(F)cc1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C31H29F5N4O5S2/c1-19-4-6-21(7-5-19)18-40(47(44,45)25-12-10-24(32)11-13-25)29-23(9-15-28(38-29)31(34,35)36)17-37-30(41)20(2)22-8-14-27(26(33)16-22)39-46(3,42)43/h4-16,20,39H,17-18H2,1-3H3,(H,37,41)
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PC cid
PC sid
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Similars

Article
PubMed
3.30n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]RTX from human TRPV1 expressed in CHO cells after 60 mins by scintillation counting analysis


Bioorg Med Chem 24: 1231-40 (2016)


Article DOI: 10.1016/j.bmc.2016.01.051
BindingDB Entry DOI: 10.7270/Q25D8TP7
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50150054
PNG
(CHEMBL3770685)
Show SMILES CC(C(=O)NCc1ccc(nc1N(Cc1ccc(C)cc1)S(=O)(=O)c1ccc(F)cc1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1S/C31H29F5N4O5S2/c1-19-4-6-21(7-5-19)18-40(47(44,45)25-12-10-24(32)11-13-25)29-23(9-15-28(38-29)31(34,35)36)17-37-30(41)20(2)22-8-14-27(26(33)16-22)39-46(3,42)43/h4-16,20,39H,17-18H2,1-3H3,(H,37,41)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

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

Similars

Article
PubMed
7.10n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 expressed in CHO cells assessed as inhibition of capsaicin-induced (45)Ca2+ uptake after 5 mins by liquid scintill...


Bioorg Med Chem 24: 1231-40 (2016)


Article DOI: 10.1016/j.bmc.2016.01.051
BindingDB Entry DOI: 10.7270/Q25D8TP7
More data for this
Ligand-Target Pair