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BDBM50184729 2-(4-(trifluoromethyl)phenyl)-6-(3-(trifluoromethyl)pyridin-2-yl)-1,2-dihydroindazol-3-one::CHEMBL3144710

SMILES: FC(F)(F)c1ccc(cc1)-n1[nH]c2cc(ccc2c1=O)-c1ncccc1C(F)(F)F

InChI Key: InChIKey=XZTHIRNRCYWVIO-UHFFFAOYSA-N

Data: 4 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 4 hits for monomerid = 50184729   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/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))
BDBM50184729
PNG
(2-(4-(trifluoromethyl)phenyl)-6-(3-(trifluoromethy...)
Show SMILES FC(F)(F)c1ccc(cc1)-n1[nH]c2cc(ccc2c1=O)-c1ncccc1C(F)(F)F
Show InChI InChI=1S/C20H11F6N3O/c21-19(22,23)12-4-6-13(7-5-12)29-18(30)14-8-3-11(10-16(14)28-29)17-15(20(24,25)26)2-1-9-27-17/h1-10,28H
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PC cid
PC sid
UniChem
Article
PubMed
n/an/a 35n/an/an/an/an/an/a



Merck Sharp & Dohme

Curated by ChEMBL


Assay Description
Antagonist activity against capsaicin-induced intracellular calcium ion increase in CHO cells expressing human TRPV1 in FLIPR assay


Bioorg Med Chem Lett 16: 2872-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.004
BindingDB Entry DOI: 10.7270/Q2959H50
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50184729
PNG
(2-(4-(trifluoromethyl)phenyl)-6-(3-(trifluoromethy...)
Show SMILES FC(F)(F)c1ccc(cc1)-n1[nH]c2cc(ccc2c1=O)-c1ncccc1C(F)(F)F
Show InChI InChI=1S/C20H11F6N3O/c21-19(22,23)12-4-6-13(7-5-12)29-18(30)14-8-3-11(10-16(14)28-29)17-15(20(24,25)26)2-1-9-27-17/h1-10,28H
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PC sid
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n/an/a 65n/an/an/an/an/an/a



Merck Sharp & Dohme

Curated by ChEMBL


Assay Description
Activity against capsaicin-induced intracellular calcium ion increase in CHO cells expressing rat TRPV1 assessed by patch clamp


Bioorg Med Chem Lett 16: 2872-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.004
BindingDB Entry DOI: 10.7270/Q2959H50
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50184729
PNG
(2-(4-(trifluoromethyl)phenyl)-6-(3-(trifluoromethy...)
Show SMILES FC(F)(F)c1ccc(cc1)-n1[nH]c2cc(ccc2c1=O)-c1ncccc1C(F)(F)F
Show InChI InChI=1S/C20H11F6N3O/c21-19(22,23)12-4-6-13(7-5-12)29-18(30)14-8-3-11(10-16(14)28-29)17-15(20(24,25)26)2-1-9-27-17/h1-10,28H
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PC sid
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n/an/a 220n/an/an/an/an/an/a



Merck Sharp & Dohme

Curated by ChEMBL


Assay Description
Activity against capsaicin-induced intracellular calcium ion increase in CHO cells expressing rat TRPV1 assessed by patch clamp


Bioorg Med Chem Lett 16: 2872-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.004
BindingDB Entry DOI: 10.7270/Q2959H50
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50184729
PNG
(2-(4-(trifluoromethyl)phenyl)-6-(3-(trifluoromethy...)
Show SMILES FC(F)(F)c1ccc(cc1)-n1[nH]c2cc(ccc2c1=O)-c1ncccc1C(F)(F)F
Show InChI InChI=1S/C20H11F6N3O/c21-19(22,23)12-4-6-13(7-5-12)29-18(30)14-8-3-11(10-16(14)28-29)17-15(20(24,25)26)2-1-9-27-17/h1-10,28H
PDB
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n/an/a 4n/an/an/an/a5.5n/a



Merck Sharp & Dohme

Curated by ChEMBL


Assay Description
Inhibition of acidic pH 5.5-stimulated current in CHO cells expressing human TRPV1 receptor by patch clamp


Bioorg Med Chem Lett 16: 2872-6 (2006)


Article DOI: 10.1016/j.bmcl.2006.03.004
BindingDB Entry DOI: 10.7270/Q2959H50
More data for this
Ligand-Target Pair