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Compile Data Set for Download or QSAR

Found 3 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM50578462'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50578462
PNG
(CHEMBL4847976)
Show SMILES CCCCC1(CCCCC1)c1cc(O)c2cc(CCC)c(=O)oc2c1
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
158n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-CP55940 from human recombinant CB1 receptor expressed in CHO-K1 cell membrane measured after 3 hrs by scintillation spectrometry


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113354
BindingDB Entry DOI: 10.7270/Q2222ZMB
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50578462
PNG
(CHEMBL4847976)
Show SMILES CCCCC1(CCCCC1)c1cc(O)c2cc(CCC)c(=O)oc2c1
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
159n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-CP55940 from human recombinant CB1 receptor expressed in CHO-K1 cell membrane measured after 3 hrs by scintillation spectrometry


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113354
BindingDB Entry DOI: 10.7270/Q2222ZMB
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM50578462
PNG
(CHEMBL4847976)
Show SMILES CCCCC1(CCCCC1)c1cc(O)c2cc(CCC)c(=O)oc2c1
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
Article
PubMed
n/an/an/an/a 1.12E+3n/an/an/an/a


TBA

Assay Description
Agonist activity at human recombinant CB1 receptor expressed in CHO-K1 cell membrane assessed as increase in GTPgammaS binding pretreated for 30 mins...


Citation and Details

Article DOI: 10.1016/j.ejmech.2021.113354
BindingDB Entry DOI: 10.7270/Q2222ZMB
More data for this
Ligand-Target Pair