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BDBM50055450 CHEMBL3323686

SMILES: CCCCCc1cc(O)cc(OCCCCCCCCCCC(=O)NCc2ccccc2)c1

InChI Key: InChIKey=XPUSKIRYBYTULV-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 = 50055450   
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))
BDBM50055450
PNG
(CHEMBL3323686)
Show SMILES CCCCCc1cc(O)cc(OCCCCCCCCCCC(=O)NCc2ccccc2)c1
Show InChI InChI=1S/C29H43NO3/c1-2-3-11-18-26-21-27(31)23-28(22-26)33-20-15-9-7-5-4-6-8-14-19-29(32)30-24-25-16-12-10-13-17-25/h10,12-13,16-17,21-23,31H,2-9,11,14-15,18-20,24H2,1H3,(H,30,32)
PDB

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Similars

Article
PubMed
202n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Siena

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55,940 from human recombinant CB2 receptor expressed in HEK293 cell membranes


Bioorg Med Chem 22: 4770-83 (2014)


Article DOI: 10.1016/j.bmc.2014.07.006
BindingDB Entry DOI: 10.7270/Q2TH8PCG
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50055450
PNG
(CHEMBL3323686)
Show SMILES CCCCCc1cc(O)cc(OCCCCCCCCCCC(=O)NCc2ccccc2)c1
Show InChI InChI=1S/C29H43NO3/c1-2-3-11-18-26-21-27(31)23-28(22-26)33-20-15-9-7-5-4-6-8-14-19-29(32)30-24-25-16-12-10-13-17-25/h10,12-13,16-17,21-23,31H,2-9,11,14-15,18-20,24H2,1H3,(H,30,32)
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Patents


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]CP-55,940 from human recombinant CB1 receptor expressed in HEK293 cell membranes


Bioorg Med Chem 22: 4770-83 (2014)


Article DOI: 10.1016/j.bmc.2014.07.006
BindingDB Entry DOI: 10.7270/Q2TH8PCG
More data for this
Ligand-Target Pair