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BDBM50432919 CHEMBL2376856

SMILES: O=C(N1CCCCC1)n1nnnc1Cc1ccc(cc1)-c1ccccc1

InChI Key: InChIKey=DUPKAESIJQIEMA-UHFFFAOYSA-N

Data: 4 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 6 hits for monomerid = 50432919   
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
Monoglyceride lipase


(Homo sapiens (Human))
BDBM50432919
PNG
(CHEMBL2376856)
Show SMILES O=C(N1CCCCC1)n1nnnc1Cc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H21N5O/c26-20(24-13-5-2-6-14-24)25-19(21-22-23-25)15-16-9-11-18(12-10-16)17-7-3-1-4-8-17/h1,3-4,7-12H,2,5-6,13-15H2
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n/an/a>1.00E+3n/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Inhibition of MAGL (unknown origin) expressed in African green monkey COS7 cell cytosolic fraction assessed as [3H]2-AG hydrolysis to [3H]arachidonic...


Eur J Med Chem 63: 118-32 (2013)


Article DOI: 10.1016/j.ejmech.2013.02.005
BindingDB Entry DOI: 10.7270/Q2K64KFB
More data for this
Ligand-Target Pair
Fatty-acid amide hydrolase 1 (aa 30-579)


(Rattus norvegicus (rat))
BDBM50432919
PNG
(CHEMBL2376856)
Show SMILES O=C(N1CCCCC1)n1nnnc1Cc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H21N5O/c26-20(24-13-5-2-6-14-24)25-19(21-22-23-25)15-16-9-11-18(12-10-16)17-7-3-1-4-8-17/h1,3-4,7-12H,2,5-6,13-15H2
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n/an/a 38n/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Inhibition of FAAH in rat brain membranes assessed as [14C]AEA hydrolysis to [14C]Ethanolamine after 30 mins by scintillation counting analysis


Eur J Med Chem 63: 118-32 (2013)


Article DOI: 10.1016/j.ejmech.2013.02.005
BindingDB Entry DOI: 10.7270/Q2K64KFB
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50432919
PNG
(CHEMBL2376856)
Show SMILES O=C(N1CCCCC1)n1nnnc1Cc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H21N5O/c26-20(24-13-5-2-6-14-24)25-19(21-22-23-25)15-16-9-11-18(12-10-16)17-7-3-1-4-8-17/h1,3-4,7-12H,2,5-6,13-15H2
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n/an/an/an/a 5.90E+3n/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at human TRPV1 receptor expressed in HEK293 cells assessed as increase in intracellular Ca2+ concentration by spectrofluorimetric an...


Eur J Med Chem 63: 118-32 (2013)


Article DOI: 10.1016/j.ejmech.2013.02.005
BindingDB Entry DOI: 10.7270/Q2K64KFB
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1


(Rattus norvegicus)
BDBM50432919
PNG
(CHEMBL2376856)
Show SMILES O=C(N1CCCCC1)n1nnnc1Cc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H21N5O/c26-20(24-13-5-2-6-14-24)25-19(21-22-23-25)15-16-9-11-18(12-10-16)17-7-3-1-4-8-17/h1,3-4,7-12H,2,5-6,13-15H2
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n/an/an/an/a 6.50E+3n/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Agonist activity at rat TRPA1 receptor expressed in HEK293 cells assessed as increase in intracellular Ca2+ concentration by spectrofluorimetric anal...


Eur J Med Chem 63: 118-32 (2013)


Article DOI: 10.1016/j.ejmech.2013.02.005
BindingDB Entry DOI: 10.7270/Q2K64KFB
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Homo sapiens (Human))
BDBM50432919
PNG
(CHEMBL2376856)
Show SMILES O=C(N1CCCCC1)n1nnnc1Cc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H21N5O/c26-20(24-13-5-2-6-14-24)25-19(21-22-23-25)15-16-9-11-18(12-10-16)17-7-3-1-4-8-17/h1,3-4,7-12H,2,5-6,13-15H2
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Article
PubMed
n/an/a 2.26E+4n/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Antagonist activity at human TRPV1 receptor expressed in HEK293 cells assessed as inhibition of capsaicin-induced intracellular Ca2+ elevation incuba...


Eur J Med Chem 63: 118-32 (2013)


Article DOI: 10.1016/j.ejmech.2013.02.005
BindingDB Entry DOI: 10.7270/Q2K64KFB
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily A member 1


(Rattus norvegicus)
BDBM50432919
PNG
(CHEMBL2376856)
Show SMILES O=C(N1CCCCC1)n1nnnc1Cc1ccc(cc1)-c1ccccc1
Show InChI InChI=1S/C20H21N5O/c26-20(24-13-5-2-6-14-24)25-19(21-22-23-25)15-16-9-11-18(12-10-16)17-7-3-1-4-8-17/h1,3-4,7-12H,2,5-6,13-15H2
PDB

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UniChem

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Article
PubMed
n/an/a 1.25E+4n/an/an/an/an/an/a



Sapienza Universit£ di Roma

Curated by ChEMBL


Assay Description
Antagonist activity at rat TRPA1 receptor expressed in HEK293 cells assessed as inhibition of allyl isothiocyanate-induced intracellular Ca2+ elevati...


Eur J Med Chem 63: 118-32 (2013)


Article DOI: 10.1016/j.ejmech.2013.02.005
BindingDB Entry DOI: 10.7270/Q2K64KFB
More data for this
Ligand-Target Pair