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BDBM50494095 CHEMBL2441264

SMILES: CCCCCn1c2ccccc2c2cc(ccc12)C(=O)CN1CCCCC1

InChI Key: InChIKey=XBLZZHYXIAAHDK-UHFFFAOYSA-N

Data: 2 KI

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 = 50494095   
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
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50494095
PNG
(CHEMBL2441264)
Show SMILES CCCCCn1c2ccccc2c2cc(ccc12)C(=O)CN1CCCCC1
Show InChI InChI=1S/C24H30N2O/c1-2-3-7-16-26-22-11-6-5-10-20(22)21-17-19(12-13-23(21)26)24(27)18-25-14-8-4-9-15-25/h5-6,10-13,17H,2-4,7-9,14-16,18H2,1H3
PDB

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UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
PC cid
PC sid
UniChem
Article
PubMed
1.09E+3n/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
Cannabinoid receptor


(Rattus norvegicus (rat))
BDBM50494095
PNG
(CHEMBL2441264)
Show SMILES CCCCCn1c2ccccc2c2cc(ccc12)C(=O)CN1CCCCC1
Show InChI InChI=1S/C24H30N2O/c1-2-3-7-16-26-22-11-6-5-10-20(22)21-17-19(12-13-23(21)26)24(27)18-25-14-8-4-9-15-25/h5-6,10-13,17H,2-4,7-9,14-16,18H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

GoogleScholar
PC cid
PC sid
UniChem
Article
PubMed
3.33E+3n/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