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BDBM50288369 CHEMBL4172580

SMILES: CC\C=C/C\C=C/C\C=C/CC1OC1C\C=C/C\C=C/CCC(=O)NCCCO

InChI Key: InChIKey=BGSMYQXGSBZQKC-UQZHZJRSSA-N

Data: 2 EC50

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

Found 2 hits for monomerid = 50288369   
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))
BDBM50288369
PNG
(CHEMBL4172580)
Show SMILES CC\C=C/C\C=C/C\C=C/CC1OC1C\C=C/C\C=C/CCC(=O)NCCCO
Show InChI InChI=1S/C25H39NO3/c1-2-3-4-5-6-7-8-11-14-18-23-24(29-23)19-15-12-9-10-13-16-20-25(28)26-21-17-22-27/h3-4,6-7,10-15,23-24,27H,2,5,8-9,16-22H2,1H3,(H,26,28)/b4-3-,7-6-,13-10-,14-11-,15-12-
PDB

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KEGG

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KEGG
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 7.30n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonist activity at N-terminal FLAG-tagged human CB2 receptor transfected in human HTLA cells assessed as induction of beta-arrestin-recruitment afte...


J Med Chem 61: 5569-5579 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00243
BindingDB Entry DOI: 10.7270/Q2P84FDV
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50288369
PNG
(CHEMBL4172580)
Show SMILES CC\C=C/C\C=C/C\C=C/CC1OC1C\C=C/C\C=C/CCC(=O)NCCCO
Show InChI InChI=1S/C25H39NO3/c1-2-3-4-5-6-7-8-11-14-18-23-24(29-23)19-15-12-9-10-13-16-20-25(28)26-21-17-22-27/h3-4,6-7,10-15,23-24,27H,2,5,8-9,16-22H2,1H3,(H,26,28)/b4-3-,7-6-,13-10-,14-11-,15-12-
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt
UniProtKB/TrEMBL

DrugBank
antibodypedia
GoogleScholar
AffyNet 
KEGG
PC cid
PC sid
UniChem

Patents


Similars

Article
PubMed
n/an/an/an/a 0.190n/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Agonist activity at N-terminal FLAG-tagged human CB1 receptor transfected in human HTLA cells assessed as induction of beta-arrestin-recruitment afte...


J Med Chem 61: 5569-5579 (2018)


Article DOI: 10.1021/acs.jmedchem.8b00243
BindingDB Entry DOI: 10.7270/Q2P84FDV
More data for this
Ligand-Target Pair