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BDBM50140156 CHEMBL2387062

SMILES: COc1ccccc1\C=C\c1ccccc1

InChI Key: InChIKey=FLQOKJWUYDGZIT-VAWYXSNFSA-N

Data: 3 IC50  2 EC50

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 5 hits for monomerid = 50140156   
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))
BDBM50140156
PNG
(CHEMBL2387062)
Show SMILES COc1ccccc1\C=C\c1ccccc1
Show InChI InChI=1S/C15H14O/c1-16-15-10-6-5-9-14(15)12-11-13-7-3-2-4-8-13/h2-12H,1H3/b12-11+
PDB
MMDB

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n/an/a>1.00E+4n/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


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


Bioorg Med Chem Lett 26: 899-902 (2016)


BindingDB Entry DOI: 10.7270/Q2765H6N
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1


(Rattus norvegicus)
BDBM50140156
PNG
(CHEMBL2387062)
Show SMILES COc1ccccc1\C=C\c1ccccc1
Show InChI InChI=1S/C15H14O/c1-16-15-10-6-5-9-14(15)12-11-13-7-3-2-4-8-13/h2-12H,1H3/b12-11+
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n/an/an/an/a 880n/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at rat TRPA1 expressed in HEK293 cells assessed as induction of intracellular calcium level


Bioorg Med Chem Lett 26: 899-902 (2016)


BindingDB Entry DOI: 10.7270/Q2765H6N
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1


(Homo sapiens (Human))
BDBM50140156
PNG
(CHEMBL2387062)
Show SMILES COc1ccccc1\C=C\c1ccccc1
Show InChI InChI=1S/C15H14O/c1-16-15-10-6-5-9-14(15)12-11-13-7-3-2-4-8-13/h2-12H,1H3/b12-11+
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Article
PubMed
n/an/a 1.70E+3n/an/an/an/an/an/a



Hyogo University of Health Sciences

Curated by ChEMBL


Assay Description
Inhibition of TRPA1 (unknown origin)


Bioorg Med Chem Lett 27: 3167-3172 (2017)


Article DOI: 10.1016/j.bmcl.2017.05.025
BindingDB Entry DOI: 10.7270/Q2TH8Q4R
More data for this
Ligand-Target Pair
Nuclear factor erythroid 2-related factor 2


(Homo sapiens (Human))
BDBM50140156
PNG
(CHEMBL2387062)
Show SMILES COc1ccccc1\C=C\c1ccccc1
Show InChI InChI=1S/C15H14O/c1-16-15-10-6-5-9-14(15)12-11-13-7-3-2-4-8-13/h2-12H,1H3/b12-11+
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PubMed
n/an/an/an/a 4.40E+3n/an/an/an/a



University of New Mexico

Curated by ChEMBL


Assay Description
Activation of Nrf2 (unknown origin) expressed in human HepG2 cells after 5 hrs by ARE-driven luciferase reporter gene assay


Bioorg Med Chem 25: 1423-1430 (2017)


Article DOI: 10.1016/j.bmc.2017.01.005
BindingDB Entry DOI: 10.7270/Q23T9KDN
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1


(Rattus norvegicus)
BDBM50140156
PNG
(CHEMBL2387062)
Show SMILES COc1ccccc1\C=C\c1ccccc1
Show InChI InChI=1S/C15H14O/c1-16-15-10-6-5-9-14(15)12-11-13-7-3-2-4-8-13/h2-12H,1H3/b12-11+
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n/an/a 1.70E+3n/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at rat TRPA1 expressed in HEK293 cells assessed as induction of intracellular calcium level


Bioorg Med Chem Lett 26: 899-902 (2016)


BindingDB Entry DOI: 10.7270/Q2765H6N
More data for this
Ligand-Target Pair