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BDBM50358961 CHEMBL1923775

SMILES: CCCCCc1cc(O)cc(OCCCCCCCCCCC(=O)OCC(O)CO)c1

InChI Key: InChIKey=WLFGLGDDDYUWMO-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 = 50358961   
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))
BDBM50358961
PNG
(CHEMBL1923775)
Show SMILES CCCCCc1cc(O)cc(OCCCCCCCCCCC(=O)OCC(O)CO)c1
Show InChI InChI=1S/C25H42O6/c1-2-3-10-13-21-16-22(27)18-24(17-21)30-15-12-9-7-5-4-6-8-11-14-25(29)31-20-23(28)19-26/h16-18,23,26-28H,2-15,19-20H2,1H3
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
KEGG
PC cid
PC sid
UniChem

Similars

Article
PubMed
7.91E+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))
BDBM50358961
PNG
(CHEMBL1923775)
Show SMILES CCCCCc1cc(O)cc(OCCCCCCCCCCC(=O)OCC(O)CO)c1
Show InChI InChI=1S/C25H42O6/c1-2-3-10-13-21-16-22(27)18-24(17-21)30-15-12-9-7-5-4-6-8-11-14-25(29)31-20-23(28)19-26/h16-18,23,26-28H,2-15,19-20H2,1H3
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