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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Transient receptor potential cation channel subfamily V member 1' and Ligand = 'BDBM50128988'   
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))
BDBM50128988
PNG
(CHEMBL3629495)
Show SMILES CC(C(=O)NCc1ccc(cc1N1CCC(CC1)c1ccc(F)cc1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
Show InChI InChI=1/C29H30F5N3O3S/c1-18(21-6-10-26(25(31)15-21)36-41(2,39)40)28(38)35-17-22-3-7-23(29(32,33)34)16-27(22)37-13-11-20(12-14-37)19-4-8-24(30)9-5-19/h3-10,15-16,18,20,36H,11-14,17H2,1-2H3,(H,35,38)
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MMDB

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PC cid
PC sid
UniChem
PubMed
0.900n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 heterologously expressed in CHO cells assessed as inhibition of capsaicin-induced activation by FLIPR assay


Bioorg Med Chem 23: 6844-54 (2015)


BindingDB Entry DOI: 10.7270/Q2DZ0B4X
More data for this
Ligand-Target Pair