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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 = 'BDBM50319470'   
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))
BDBM50319470
PNG
(1-(2-(3-fluoro-3-methylbutyl)-4-(trifluoromethyl)b...)
Show SMILES CC(C)(F)CCc1cc(ccc1CNC(=O)Nc1cccc2[nH]ncc12)C(F)(F)F
Show InChI InChI=1S/C21H22F4N4O/c1-20(2,22)9-8-13-10-15(21(23,24)25)7-6-14(13)11-26-19(30)28-17-4-3-5-18-16(17)12-27-29-18/h3-7,10,12H,8-9,11H2,1-2H3,(H,27,29)(H2,26,28,30)
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MMDB

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Article
PubMed
n/an/a 6n/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1


Bioorg Med Chem Lett 20: 3291-4 (2010)


Article DOI: 10.1016/j.bmcl.2010.04.047
BindingDB Entry DOI: 10.7270/Q2B27VF7
More data for this
Ligand-Target Pair