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BDBM50420681 CHEMBL2087052

SMILES: CC(C)c1ccc(C)cc1C(=O)Nc1ccc(cc1)C(C)(C)C

InChI Key: InChIKey=YNRVLEWFYBKYND-UHFFFAOYSA-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 = 50420681   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Transient receptor potential M8 protein (TRPM8)


(Rattus norvegicus (Rat))
BDBM50420681
PNG
(CHEMBL2087052)
Show SMILES CC(C)c1ccc(C)cc1C(=O)Nc1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C21H27NO/c1-14(2)18-12-7-15(3)13-19(18)20(23)22-17-10-8-16(9-11-17)21(4,5)6/h7-14H,1-6H3,(H,22,23)
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Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of rat TRPM8 expressed in HEK293 cells assessed as reduction in 20 uM menthol-stimulated increase in intracellular Ca2+ levels


Bioorg Med Chem Lett 22: 3535-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.055
BindingDB Entry DOI: 10.7270/Q2M61MJ8
More data for this
Ligand-Target Pair
Transient receptor potential M8 protein (TRPM8)


(Rattus norvegicus (Rat))
BDBM50420681
PNG
(CHEMBL2087052)
Show SMILES CC(C)c1ccc(C)cc1C(=O)Nc1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C21H27NO/c1-14(2)18-12-7-15(3)13-19(18)20(23)22-17-10-8-16(9-11-17)21(4,5)6/h7-14H,1-6H3,(H,22,23)
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Article
PubMed
n/an/a 1.90E+3n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of rat TRPM8 expressed in HEK293 cells assessed as reduction in 0.25 uM icilin-stimulated increase in intracellular Ca2+ levels


Bioorg Med Chem Lett 22: 3535-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.055
BindingDB Entry DOI: 10.7270/Q2M61MJ8
More data for this
Ligand-Target Pair
Transient receptor potential M8 protein (TRPM8)


(Rattus norvegicus (Rat))
BDBM50420681
PNG
(CHEMBL2087052)
Show SMILES CC(C)c1ccc(C)cc1C(=O)Nc1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C21H27NO/c1-14(2)18-12-7-15(3)13-19(18)20(23)22-17-10-8-16(9-11-17)21(4,5)6/h7-14H,1-6H3,(H,22,23)
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UniChem

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Article
PubMed
n/an/an/an/a 600n/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Activation of rat TRPM8 expressed in HEK293 cells assessed as stimulation of intracellular Ca2+ levels


Bioorg Med Chem Lett 22: 3535-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.055
BindingDB Entry DOI: 10.7270/Q2M61MJ8
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1


(Rattus norvegicus)
BDBM50420681
PNG
(CHEMBL2087052)
Show SMILES CC(C)c1ccc(C)cc1C(=O)Nc1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C21H27NO/c1-14(2)18-12-7-15(3)13-19(18)20(23)22-17-10-8-16(9-11-17)21(4,5)6/h7-14H,1-6H3,(H,22,23)
PDB

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KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 600n/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Activation of rat TRPA1 expressed in HEK293 cells assessed as stimulation of intracellular Ca2+ levels


Bioorg Med Chem Lett 22: 3535-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.055
BindingDB Entry DOI: 10.7270/Q2M61MJ8
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1


(Rattus norvegicus)
BDBM50420681
PNG
(CHEMBL2087052)
Show SMILES CC(C)c1ccc(C)cc1C(=O)Nc1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C21H27NO/c1-14(2)18-12-7-15(3)13-19(18)20(23)22-17-10-8-16(9-11-17)21(4,5)6/h7-14H,1-6H3,(H,22,23)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/a 840n/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of rat TRPA1 expressed in HEK293 cells assessed as reduction in 100 uM allyl isothiocyanate-stimulated increase in intracellular Ca2+ leve...


Bioorg Med Chem Lett 22: 3535-9 (2012)


Article DOI: 10.1016/j.bmcl.2012.03.055
BindingDB Entry DOI: 10.7270/Q2M61MJ8
More data for this
Ligand-Target Pair