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BDBM50175112 (5Z,8Z,11Z,14Z)-N-(4-methoxybenzyl)icosa-5,8,11,14-tetraenamide::CHEMBL198079

SMILES: CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCc1ccc(OC)cc1

InChI Key: InChIKey=AWKAXTNPAOUFMN-ZKWNWVNESA-N

Data: 2 KI

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Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50175112   
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


(Homo sapiens (Human))
BDBM50175112
PNG
((5Z,8Z,11Z,14Z)-N-(4-methoxybenzyl)icosa-5,8,11,14...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCc1ccc(OC)cc1
Show InChI InChI=1S/C28H41NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28(30)29-25-26-21-23-27(31-2)24-22-26/h7-8,10-11,13-14,16-17,21-24H,3-6,9,12,15,18-20,25H2,1-2H3,(H,29,30)/b8-7-,11-10-,14-13-,17-16-
PDB

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KEGG

UniProtKB/SwissProt

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antibodypedia
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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
600n/an/an/an/an/an/an/an/a



Institute of Biomolecular Chemistry

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human recombinant CB1 receptor


Bioorg Med Chem Lett 16: 138-41 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.023
BindingDB Entry DOI: 10.7270/Q2JQ11SX
More data for this
Ligand-Target Pair
Cannabinoid receptor 2


(Homo sapiens (Human))
BDBM50175112
PNG
((5Z,8Z,11Z,14Z)-N-(4-methoxybenzyl)icosa-5,8,11,14...)
Show SMILES CCCCC\C=C/C\C=C/C\C=C/C\C=C/CCCC(=O)NCc1ccc(OC)cc1
Show InChI InChI=1S/C28H41NO2/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-28(30)29-25-26-21-23-27(31-2)24-22-26/h7-8,10-11,13-14,16-17,21-24H,3-6,9,12,15,18-20,25H2,1-2H3,(H,29,30)/b8-7-,11-10-,14-13-,17-16-
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
4.50E+3n/an/an/an/an/an/an/an/a



Institute of Biomolecular Chemistry

Curated by ChEMBL


Assay Description
Displacement of [3H]CP-55940 from human recombinant CB2 receptor


Bioorg Med Chem Lett 16: 138-41 (2005)


Article DOI: 10.1016/j.bmcl.2005.09.023
BindingDB Entry DOI: 10.7270/Q2JQ11SX
More data for this
Ligand-Target Pair