BindingDB logo
myBDB logout

null

SMILES: CCCCCn1c2ccccc2c2cc(CN3CCN(C)CC3)ccc12

InChI Key: InChIKey=DTQBKFAICYPMQR-UHFFFAOYSA-N

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 2 hits for monomerid = 50494108   
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
Cannabinoid receptor 1


(Rattus norvegicus (rat))
BDBM50494108
PNG
(CHEMBL2441447)
Show SMILES CCCCCn1c2ccccc2c2cc(CN3CCN(C)CC3)ccc12
Show InChI InChI=1S/C23H31N3/c1-3-4-7-12-26-22-9-6-5-8-20(22)21-17-19(10-11-23(21)26)18-25-15-13-24(2)14-16-25/h5-6,8-11,17H,3-4,7,12-16,18H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
244n/an/an/an/an/an/an/an/a



The University of Montana

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from CB1 receptor in rat brain homogenate after 1.5 hrs by microbeta liquid scintillation counting analysis


Eur J Med Chem 69: 881-907 (2013)


Article DOI: 10.1016/j.ejmech.2013.09.038
BindingDB Entry DOI: 10.7270/Q20P12Z8
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50494108
PNG
(CHEMBL2441447)
Show SMILES CCCCCn1c2ccccc2c2cc(CN3CCN(C)CC3)ccc12
Show InChI InChI=1S/C23H31N3/c1-3-4-7-12-26-22-9-6-5-8-20(22)21-17-19(10-11-23(21)26)18-25-15-13-24(2)14-16-25/h5-6,8-11,17H,3-4,7,12-16,18H2,1-2H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
740n/an/an/an/an/an/an/an/a



The University of Montana

Curated by ChEMBL


Assay Description
Displacement of [3H]-CP55940 from human CB2 receptor expressed in HEK293 cells after 1.5 hrs by microbeta liquid scintillation counting analysis


Eur J Med Chem 69: 881-907 (2013)


Article DOI: 10.1016/j.ejmech.2013.09.038
BindingDB Entry DOI: 10.7270/Q20P12Z8
More data for this
Ligand-Target Pair