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BDBM50358944 CHEMBL1923758

SMILES: CCCCCCc1ccc(OCCCCCCCC(=O)OC(CO)CO)cc1O

InChI Key: InChIKey=IFGYCSXHVCOPGU-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 = 50358944   
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 2


(Homo sapiens (Human))
BDBM50358944
PNG
(CHEMBL1923758)
Show SMILES CCCCCCc1ccc(OCCCCCCCC(=O)OC(CO)CO)cc1O
Show InChI InChI=1S/C23H38O6/c1-2-3-4-8-11-19-13-14-20(16-22(19)26)28-15-10-7-5-6-9-12-23(27)29-21(17-24)18-25/h13-14,16,21,24-26H,2-12,15,17-18H2,1H3
PDB

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KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
7.87E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB2 receptor expressed in human HEK293 cells


J Med Chem 54: 8278-88 (2011)


Article DOI: 10.1021/jm200529h
BindingDB Entry DOI: 10.7270/Q23J3DC3
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50358944
PNG
(CHEMBL1923758)
Show SMILES CCCCCCc1ccc(OCCCCCCCC(=O)OC(CO)CO)cc1O
Show InChI InChI=1S/C23H38O6/c1-2-3-4-8-11-19-13-14-20(16-22(19)26)28-15-10-7-5-6-9-12-23(27)29-21(17-24)18-25/h13-14,16,21,24-26H,2-12,15,17-18H2,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

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



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]CP55940 from human CB1 receptor expressed in human HEK293 cells


J Med Chem 54: 8278-88 (2011)


Article DOI: 10.1021/jm200529h
BindingDB Entry DOI: 10.7270/Q23J3DC3
More data for this
Ligand-Target Pair