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BDBM50074620 CHEMBL171447::N-(2-hydroxyethyl)stearamide::Octadecanoic acid (2-hydroxy-ethyl)-amide

SMILES: CCCCCCCCCCCCCCCCCC(=O)NCCO

InChI Key: InChIKey=OTGQIQQTPXJQRG-UHFFFAOYSA-N

Data: 1 KI  2 IC50

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 3 hits for monomerid = 50074620   
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


(Rattus norvegicus (rat))
BDBM50074620
PNG
(CHEMBL171447 | N-(2-hydroxyethyl)stearamide | Octa...)
Show SMILES CCCCCCCCCCCCCCCCCC(=O)NCCO
Show InChI InChI=1S/C20H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h22H,2-19H2,1H3,(H,21,23)
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Article
PubMed
217n/an/an/an/an/an/an/an/a



University of Connecticut

Curated by ChEMBL


Assay Description
Tested for binding affinity to Cannabinoid receptor 1


J Med Chem 42: 896-902 (1999)


Article DOI: 10.1021/jm980461j
BindingDB Entry DOI: 10.7270/Q2XG9Q9Z
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus)
BDBM50074620
PNG
(CHEMBL171447 | N-(2-hydroxyethyl)stearamide | Octa...)
Show SMILES CCCCCCCCCCCCCCCCCC(=O)NCCO
Show InChI InChI=1S/C20H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h22H,2-19H2,1H3,(H,21,23)
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CHEMBL
MCE
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PC sid
UniChem

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



National Research Council (CNR)

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant rat TRPV2 expressed in HEK293 cells assessed as inhibition of CBD-induced Ca2+ levels preincubated for 5 mins foll...


J Med Chem 61: 8255-8281 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00734
BindingDB Entry DOI: 10.7270/Q2222XFP
More data for this
Ligand-Target Pair
Vanilloid receptor


(Rattus norvegicus)
BDBM50074620
PNG
(CHEMBL171447 | N-(2-hydroxyethyl)stearamide | Octa...)
Show SMILES CCCCCCCCCCCCCCCCCC(=O)NCCO
Show InChI InChI=1S/C20H41NO2/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-20(23)21-18-19-22/h22H,2-19H2,1H3,(H,21,23)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
Purchase

CHEMBL
MCE
KEGG
PC cid
PC sid
UniChem

Patents


Similars

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



National Research Council (CNR)

Curated by ChEMBL


Assay Description
Antagonist activity at recombinant rat TRPV2 expressed in HEK293 cells assessed as inhibition of LPC-induced Ca2+ levels preincubated for 5 mins foll...


J Med Chem 61: 8255-8281 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00734
BindingDB Entry DOI: 10.7270/Q2222XFP
More data for this
Ligand-Target Pair