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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Cannabinoid receptor 1' and Ligand = 'BDBM181239'   
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))
BDBM181239
PNG
(US9139546, 26)
Show SMILES Cc1cccc(c1)-c1c(O)cc(cc1O)C(=O)c1ccccc1
Show InChI InChI=1S/C20H16O3/c1-13-6-5-9-15(10-13)19-17(21)11-16(12-18(19)22)20(23)14-7-3-2-4-8-14/h2-12,21-22H,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

US Patent
983 -34.9n/an/an/an/an/an/a30



The University of Tennessee Research Foundation

US Patent


Assay Description
Cell membranes from HEK293 cells transfected with the human CB1 receptor and membranes from CHO-K1 cells transfected with the human CB2 receptor were...


US Patent US9139546 (2015)


BindingDB Entry DOI: 10.7270/Q2TQ609M
More data for this
Ligand-Target Pair
Cannabinoid receptor 1


(Homo sapiens (Human))
BDBM181239
PNG
(US9139546, 26)
Show SMILES Cc1cccc(c1)-c1c(O)cc(cc1O)C(=O)c1ccccc1
Show InChI InChI=1S/C20H16O3/c1-13-6-5-9-15(10-13)19-17(21)11-16(12-18(19)22)20(23)14-7-3-2-4-8-14/h2-12,21-22H,1H3
PDB

NCI pathway
Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

Article
PubMed
4.02E+3n/an/an/an/an/an/an/an/a


TBA

Assay Description
Displacement of [3H]-CP55940 from human recombinant cannabinoid CB1 receptor expressed in HEK cell membranes incubated for 1.5 hrs by liquid scintill...


Citation and Details

Article DOI: 10.1016/j.bmc.2021.116035
BindingDB Entry DOI: 10.7270/Q2K077Z0
More data for this
Ligand-Target Pair